SCHEMBL418180

SCHEMBL418180

COC(=O)c1c[nH]nc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.62
MAPT P10636 2/20 0.52
ALDH1A1 P00352 3/20 0.50
AXL P30530 1/20 0.49
GAA P10253 2/20 0.49
NR4A2 P43354 2/20 0.48
PTGS1 P23219 1/20 0.48
GABRA1 P14867 1/20 0.47
GABRG2 P18507 1/20 0.47
GABRB3 P28472 1/20 0.47
GABRA5 P31644 1/20 0.47
GABRA3 P34903 1/20 0.47
HTT P42858 1/20 0.45
CREBBP Q92793 1/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL27886009 0.90 NR4A2 (0.52) SMN1; SMN2MAPTALDH1A1AXLGAA
SCHEMBL8189911 0.90 SMN1; SMN2 (0.55) SMN1; SMN2MAPTALDH1A1AXLGAA
SCHEMBL28202943 0.84 SLC6A4 (0.53) SMN1; SMN2MAPTALDH1A1LMNAKMT2A
SCHEMBL11957361 0.83 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1GAAPTGS1
SCHEMBL2921221 0.83 JAK2 (0.57) SMN1; SMN2MAPTALDH1A1GAALMNA
SCHEMBL7729548 0.82 KDM4E (0.50) SMN1; SMN2MAPTALDH1A1GAAPTGS1
SCHEMBL415485 0.82 KDM4E (0.55) SMN1; SMN2MAPTALDH1A1NR4A2PTGS1
SCHEMBL8489134 0.81 LMNA (0.46) SMN1; SMN2MAPTALDH1A1PTGS1LMNA
SCHEMBL7666259 0.79 KDM4E (0.47) SMN1; SMN2ALDH1A1GAALMNAKDM4E
Ethylene SCHEMBL27448159 0.79 KDM4E (0.51) SMN1; SMN2MAPTALDH1A1NR4A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0135838-B1 3-PHENYL-4-METHOXYCARBONYL PYRAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AGAINST PLANT GROWTH BASF Aktiengesellschaft (DE) 1990-04-18 EP claimed
US-4537617-A HEBICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-08-27 US claimed
CN-110167933-B As αVAzole amides and amines as integrin inhibitors 百时美施贵宝公司 2022-06-21 CN disclosed
EP-3538527-B1 AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-10-13 EP disclosed
US-10851098-B2 Azole amides and amines as alpha v integrin inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-12-01 US disclosed
US-20190256513-A1 AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-08-22 US disclosed
EP-2410858-B1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME (US) 2016-09-07 EP disclosed
EP-2410858-B1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME (US) 2016-09-07 EP disclosed
US-8946231-B2 P2X3, receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2015-02-03 US disclosed
US-8946231-B2 P2X3, receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2015-02-03 US disclosed
EP-2410858-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN Merck Sharp & Dohme Corp. (US) 2012-02-01 EP disclosed
WO-2010111059-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME CORP. (US) 2010-09-30 WO disclosed
EP-0135838-B1 3-PHENYL-4-METHOXYCARBONYL PYRAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AGAINST PLANT GROWTH BASF Aktiengesellschaft (DE) 1990-04-18 EP disclosed
EP-0135838-B1 3-PHENYL-4-METHOXYCARBONYL PYRAZOLES, PROCESS FOR THEIR PREPARATION AND THEIR USE AGAINST PLANT GROWTH BASF Aktiengesellschaft (DE) 1990-04-18 EP disclosed
US-4537617-A HEBICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-08-27 US disclosed
US-4537617-A HEBICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-08-27 US disclosed
US-4537617-A HEBICIDES BASF AKTIENGESELLSCHAFT (DE) 1985-08-27 US disclosed
EP-0135838-A2 3-Phenyl-4-methoxycarbonyl pyrazoles, process for their preparation and their use against plant growth BASF Aktiengesellschaft (DE) 1985-04-03 EP disclosed
EP-0135838-A2 3-Phenyl-4-methoxycarbonyl pyrazoles, process for their preparation and their use against plant growth BASF Aktiengesellschaft (DE) 1985-04-03 EP disclosed
US-4420324-A HERBICIDES BASF AKTIENGESELLSCHAFT (US) 1983-12-13 US 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 (2 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-10851098-B2 Azole amides and amines as alpha v integrin inhibitors ITGAV, ITGB1, ITGA1 SMN1; SMN2 3383/4885MAPT 177/4885ALDH1A1 779/4885
US-20190256513-A1 AZOLE AMIDES AND AMINES AS ALPHA V INTEGRIN INHIBITORS ITGAV, ITGB1, ITGA1 SMN1; SMN2 3383/4885MAPT 177/4885ALDH1A1 779/4885

“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.