Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6014613

CCCCCc1cccnc1.N

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.96
L3MBTL1 Q9Y468 1/20 0.96
HRH1 P35367 2/20 0.62
CYP2A6 P11509 1/20 0.61
TBXAS1 P24557 7/20 0.57
TRPV1 Q8NER1 1/20 0.57
CHRNA7 P36544 2/20 0.55
CHRNB2 P17787 2/20 0.55
CHRNA4 P43681 2/20 0.55
HRH4 Q9H3N8 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL135032 0.98 TDP1 (1.00) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL6114977 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL6114843 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL6115248 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL25381701 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL25381172 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL25380936 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL25382598 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
Bromide SCHEMBL15822430 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1
SCHEMBL6115279 0.96 TDP1 (0.96) TDP1L3MBTL1HRH1CYP2A6TBXAS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 138 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230109457-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-04-06 US claimed
US-11351161-B2 Use of CDK9 inhibitors to reduce cartilage degradation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-06-07 US claimed
US-20210008054-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-01-14 US claimed
US-20200046726-A1 USE OF CDK9 AND BRD4 INHIBITORS TO INHIBIT INFLAMMATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-13 US claimed
US-20190255034-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-08-22 US claimed
US-10172844-B2 Use of CDK9 inhibitors to reduce cartilage degradation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-01-08 US claimed
US-11691986-B2 PTEFB inhibiting macrocyclic compounds BAYER AKTIENGESELLSCHAFT (DE) 2023-07-04 US disclosed
US-20230109457-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-04-06 US disclosed
US-20220281892-A1 NOVEL PTEFB INHIBITING MACROCYCLIC COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2022-09-08 US disclosed
US-11351161-B2 Use of CDK9 inhibitors to reduce cartilage degradation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-06-07 US disclosed
US-11254690-B2 PTEFb inhibiting macrocyclic compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-02-22 US disclosed
US-11242356-B2 PTEFb inhibiting macrocyclic compounds BAYER AKTIENGESELLSCHAFT (DE) 2022-02-08 US disclosed
EP-3601253-B1 NOVEL PTEFB INHIBITING MACROCYCLIC COMPOUNDS BAYER AG (DE) 2021-09-15 EP disclosed
WO-2013037896-A1 DISUBSTITUTED 5-FLUORO-PYRIMIDINES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-03-21 WO disclosed
US-7078406-B2 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes JOHNSON & JOHNSON PHARMACEUTICAL RESEARCH & DEVELOPMENT, L.L.C. (US) 2006-07-18 US disclosed
US-20040248851-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes Life Technologies Corporation 2004-12-09 US disclosed
US-6815445-B2 FOR USE AS FLUORESCENCE DYES AND PROBES Life Technologies Corporation 2004-11-09 US disclosed
EP-1442027-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2004-08-04 EP disclosed
US-20030105111-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes 3-DIMENSIONAL PHARMACEUTICALS, INC. 2003-06-05 US disclosed
WO-2003031419-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-04-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11242356-B2 PTEFb inhibiting macrocyclic compounds PCLAF, PPIB, RHEB TDP1 3133/4885L3MBTL1 2846/4885HRH1 3177/4885
US-20200046726-A1 USE OF CDK9 AND BRD4 INHIBITORS TO INHIBIT INFLAMMATION CDK9, BRD4, CDK19 TDP1 1555/4885L3MBTL1 1715/4885HRH1 3398/4885
US-20220281892-A1 NOVEL PTEFB INHIBITING MACROCYCLIC COMPOUNDS PCLAF, PKD1, RHEB TDP1 3371/4885L3MBTL1 2724/4885HRH1 3427/4885
US-20040248851-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes DHFR, FPR1, CYP1A1 TDP1 554/4885L3MBTL1 2205/4885HRH1 1821/4885
US-20030105111-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes DHFR, FPR1, CYP1A1 TDP1 554/4885L3MBTL1 2205/4885HRH1 1821/4885
US-20230109457-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION CDK9, CDK19, CDKN1A TDP1 810/4885L3MBTL1 2465/4885HRH1 4607/4885
US-20210008054-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION CDK9, CDK19, CDKN1A TDP1 810/4885L3MBTL1 2465/4885HRH1 4607/4885
US-20190255034-A1 USE OF CDK9 INHIBITORS TO REDUCE CARTILAGE DEGRADATION CDK9, CDK19, CDKN1A TDP1 810/4885L3MBTL1 2465/4885HRH1 4607/4885
US-11351161-B2 Use of CDK9 inhibitors to reduce cartilage degradation CDK9, CDK19, CDKN1A TDP1 810/4885L3MBTL1 2465/4885HRH1 4607/4885
US-10172844-B2 Use of CDK9 inhibitors to reduce cartilage degradation CDK9, CDK19, CDKN1A TDP1 810/4885L3MBTL1 2465/4885HRH1 4607/4885
US-11254690-B2 PTEFb inhibiting macrocyclic compounds PCLAF, PPIB, RHEB TDP1 3133/4885L3MBTL1 2846/4885HRH1 3177/4885
US-11691986-B2 PTEFB inhibiting macrocyclic compounds PCLAF, PPIB, RHEB TDP1 3133/4885L3MBTL1 2846/4885HRH1 3177/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.