SCHEMBL902268

SCHEMBL902268

CCCCCC1CCCNC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
HRH3 Q9Y5N1 3/20 0.46
NAAA Q02083 1/20 0.43
HRH4 Q9H3N8 2/20 0.41
TLR7 Q9NYK1 1/20 0.41
KMT2A Q03164 1/20 0.41
GNAO1 P09471 2/20 0.37
CPN1 P15169 1/20 0.37
CPB2 Q96IY4 1/20 0.37
GNAI3 P08754 1/20 0.36
GNAI1 P63096 1/20 0.36
EED O75530 1/20 0.36
ACP1 P24666 3/20 0.35
HTR2A P28223 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
EPHX1 P07099 1/20 0.35
BACE1 P56817 2/20 0.35

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
SCHEMBL14368874 1.00 CYP1A2 (0.48) CYP1A2HRH3NAAAHRH4TLR7
SCHEMBL14368866 1.00 CYP1A2 (0.48) CYP1A2HRH3NAAAHRH4TLR7
Hydrochloric Acid SCHEMBL4428581 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
SCHEMBL7593657 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
Hydrochloric Acid SCHEMBL4422978 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
SCHEMBL19578854 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
Hydrochloric Acid SCHEMBL4426631 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
SCHEMBL8948236 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
SCHEMBL22857512 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7
Propane SCHEMBL11130919 0.98 CYP1A2 (0.47) CYP1A2HRH3NAAAHRH4TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023028364-A1 TARGETED COMPOSITIONS AND USES THEROF SEPELO THERAPEUTICS, LLC (US) 2023-03-02 WO claimed
US-20230407244-A1 MICROBIAL GROWTH-STIMULATING PROTEIN AND METHODS OF USING SAME PARADIGM DIAGNOSTICS, INC. (US) 2023-12-21 US disclosed
US-20230303591-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-09-28 US disclosed
US-11732285-B2 Selective enrichment media and uses thereof PARADIGM DIAGNOSTICS, INC. (US) 2023-08-22 US disclosed
WO-2023028364-A1 TARGETED COMPOSITIONS AND USES THEROF SEPELO THERAPEUTICS, LLC (US) 2023-03-02 WO disclosed
WO-2022093775-A1 MICROBIAL GROWTH-STIMULATING PROTEIN AND METHODS OF USING SAME PARADIGM DIAGNOSTICS, INC. (US) 2022-05-05 WO disclosed
US-10813911-B2 Methods of treating and/or preventing chronic obstructive pulmonary disease UNIV BORDEAUX (FR) 2020-10-27 US disclosed
US-20200208099-A1 SELECTIVE ENRICHMENT MEDIA AND USES THEREOF PARADIGM DIAGNOSTICS, INC. (US) 2020-07-02 US disclosed
CN-111072550-A Nilapari important intermediate and enzyme catalytic synthesis method thereof 苏州凯瑞医药科技有限公司 2020-04-28 CN disclosed
US-10619130-B1 Selective enrichment media and uses thereof PARADIGM DIAGNOSTICS, INC. (US) 2020-04-14 US disclosed
EP-1305048-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES Wockhardt Limited (IN) 2003-05-02 EP disclosed
US-20020177559-A1 Quinolone derivatives WOCKHARDT LIMITED 2002-11-28 US disclosed
US-6451842-B1 Cyclic amine derivatives and their use as drugs DUPONT PHARMACEUTICALS COMPANY 2002-09-17 US disclosed
US-6410566-B1 ATHEROSCLEROSIS; ANTIARTHRITIC AGENTS TEIJIN LIMITED (JP) 2002-06-25 US disclosed
US-6362177-B1 INHIBITION OF CHEMOKINE BINDING TEIJIN LIMITED (JP) 2002-03-26 US disclosed
WO-2002009758-A2 INHIBITORS OF CELLULAR EFFLUX PUMPS OF MICROBES WOCKHARDT LIMITED (IN) 2002-02-07 WO disclosed
CN-1279668-A Cyclic amine derivatives and their use as pharmaceuticals TEIJIN LTD (JP) 2001-01-10 CN disclosed
WO-2000069815-A1 UREIDO-SUBSTITUTED CYCLIC AMINE DERIVATIVES AND THEIR USE AS DRUG TEIJIN LIMITED (JP) 2000-11-23 WO disclosed
EP-0077607-A1 N-substituted 3-aryl piperidines and derivatives thereof BEECHAM GROUP PLC (GB) 1983-04-27 EP disclosed
EP-0034471-A1 Piperidinoquinazolines and a process for the preparation thereof ORION-YHTYMÄ OY (FI) 1981-08-26 EP 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-20230303591-A1 RAS INHIBITORS KRAS, NRAS, HRAS CYP1A2 4452/4885HRH3 3676/4885NAAA 3957/4885
US-20020177559-A1 Quinolone derivatives ABCB11, ABCB1, ABCG2 CYP1A2 357/4885HRH3 3952/4885NAAA 588/4885

“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.