SCHEMBL160159

SCHEMBL160159

[CH]1CCNc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KDM1A O60341 1/20 0.32
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL1493703 0.86 GAA (0.35) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL448758 0.77 GAA (0.44) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL28986081 0.76 GAA (0.43) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL28264866 0.76 GAA (0.43) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL19679 0.75
SCHEMBL29144954 0.70 GAA (0.54) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL123812 0.70 GAA (0.54) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL29408147 0.70 GAA (0.54) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL1451010 0.70 DRD2 (0.50)
SCHEMBL3041192 0.70 GAA (0.41) GAAMEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233345-A1 SUBSTITUTED QUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-17 US claimed
EP-3180006-A1 SUBSTITUTED QUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2017-06-21 EP claimed
WO-2016023885-A1 SUBSTITUTED QUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-02-18 WO claimed
US-9126998-B2 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use Bayer Pharma AG (DE) 2015-09-08 US claimed
US-20140128372-A1 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US claimed
US-20130165479-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF ABBVIE, INC. (US) 2013-06-27 US claimed
EP-1905774-B1 Fused heterocyclic compounds as serotonin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2013-02-20 EP claimed
US-8350083-B2 Antagonists of the TRPV1 receptor and uses thereof ABBVIE INC. (US) 2013-01-08 US claimed
US-20120022103-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF ABBOTT LABORATORIES (US) 2012-01-26 US claimed
US-8039455-B2 Macrocyclic compounds useful as BACE inhibitors NOVARTIS AG (CH) 2011-10-18 US claimed
EP-1599174-A2 NOVEL COMPOUNDS Replidyne, Inc. (US) 2005-11-30 EP claimed
CN-1694870-A Acetyl 2-hydroxy-1, 3-diaminoalkanes PHARMACIA & UPJOHN CO LLC (US) 2005-11-09 CN claimed
US-6884802-B2 6-heteroarylphenanthridines ALTANA PHARMA AG (DE) 2005-04-26 US claimed
WO-2004069196-A2 NOVEL COMPOUNDS REPLIDYNE, INC. (US) 2004-08-19 WO claimed
US-20040038979-A1 Treating airway disorders such as asthma. ALTANA PHARMA AG (DE) 2004-02-26 US claimed
JP-2003500397-A 2003-01-07 JP claimed
JP-2003500395-A 2003-01-07 JP claimed
WO-2000071522-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS METHIONYL T-RNA SYNTHETASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2000-11-30 WO claimed
WO-2000071524-A1 2-NH-PYRIDONES AND PYRIMIDONES AS MRS INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2000-11-30 WO claimed
US-5294612-A Hypotensive agents and cardiovascular disorders STERLING WINTHROP INC. (US) 1994-03-15 US claimed

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

For each of this compound's patents that has machine-readable text (5 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-20140128372-A1 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use AADAC, TNNI3, PAICS GAA 2804/4885MEN1 2194/4885KMT2A 1080/4885
US-20170233345-A1 SUBSTITUTED QUINOLINE-4-CARBOXAMIDES AND USE THEREOF NQO2, SIRT5, BRD4 GAA 615/4885MEN1 2611/4885KMT2A 684/4885
US-20130165479-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF TRPV1, TRPV3, TRPV2 GAA 4177/4885MEN1 3744/4885KMT2A 4629/4885
US-20040038979-A1 Treating airway disorders such as asthma. PTGER4, PDE4B, PDE4A GAA 4138/4885MEN1 4313/4885KMT2A 3933/4885
US-20120022103-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF TRPV1, TRPV3, TRPV2 GAA 4072/4885MEN1 3677/4885KMT2A 4540/4885

“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.