SCHEMBL6175337

SCHEMBL6175337

Cn1nc(-c2ccc(F)cc2)c(-c2ccncc2)c1NC(=O)Cn1cccn1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.50
EGFR P00533 1/20 0.46
RAF1 P04049 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA2B P29275 1/20 0.46
ADORA1 P30542 1/20 0.46
GSK3B P49841 1/20 0.46
KDM4E B2RXH2 1/20 0.44
MAPT P10636 2/20 0.41
CSNK1D P48730 2/20 0.41
CSNK1E P49674 2/20 0.41
NAMPT P43490 1/20 0.41
CSNK1A1 P48729 1/20 0.40

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
SCHEMBL6175447 0.89 MAPK14 (0.45) MAPK14EGFRRAF1ADORA3ADORA2A
SCHEMBL6179169 0.83 MAPK14 (0.63) MAPK14KDM4EMAPTCSNK1DCSNK1E
SCHEMBL6176832 0.83 MAPK14 (0.63) MAPK14KDM4EMAPTCSNK1DCSNK1E
SCHEMBL7138225 0.83 MAPK14 (0.55) MAPK14KDM4EMAPTCSNK1DCSNK1E
SCHEMBL4343331 0.83 MAPK14 (0.71) MAPK14EGFRRAF1ADORA3ADORA2A
SCHEMBL6177420 0.82 MAPK14 (0.57) MAPK14KDM4EMAPTCSNK1DCSNK1E
SCHEMBL6175636 0.82 MAPK14 (0.51) MAPK14KDM4EMAPTCSNK1DCSNK1E
SCHEMBL6178426 0.81 MAPK14 (0.56) MAPK14EGFRRAF1ADORA3ADORA2A
SCHEMBL6180619 0.81 MAPK14 (0.53) MAPK14EGFRRAF1ADORA3ADORA2A
SCHEMBL6177363 0.81 MAPK14 (0.52) MAPK14KDM4EMAPTCSNK1DCSNK1E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1142890-B1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2005-08-03 EP disclosed
EP-1142890-A1 AMINOPYRAZOLE DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-10-10 EP disclosed