SCHEMBL627438

SCHEMBL627438

Fc1cc(F)c2c(c1)CCNC2

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PNMT P11086 9/20 0.48
ADRA2A P08913 2/20 0.40
ADRA2B P18089 2/20 0.40
ADRA2C P18825 2/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
CD44 P16070 1/20 0.39
MAOB P27338 1/20 0.39
PARP1 P09874 1/20 0.38
ASIC3 Q9UHC3 1/20 0.37

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
SCHEMBL30899242 0.85 HTR2C (0.48) PNMTHTR2AHTR2CHTR2B
SCHEMBL30014809 0.83 CD44 (0.40) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL16402066 0.83 CD44 (0.40) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL19684582 0.82 PNMT (0.44) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL19711548 0.82 PNMT (0.44) PNMTADRA2AADRA2BADRA2CCD44
SCHEMBL19667270 0.82 ADCY6 (0.45) PNMTADRA2AADRA2BADRA2CCD44
SCHEMBL31159009 0.80 HTR2C (0.30) HTR2CMAOB
SCHEMBL25095628 0.80 PNMT (0.46) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL19406882 0.80 PNMT (0.46) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL17462463 0.80 PNMT (0.50) PNMTADRA2AADRA2BADRA2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612131-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2025-09-10 EP disclosed
WO-2024095003-A1 NICOTINAMIDE DERIVATIVES FOR USE IN TREATING DISORDERS ASSOCIATED WITH KCNK13 ACTIVITY Cerevance, Inc. (US) 2024-05-10 WO disclosed
CN-117751104-A Compound with kinase inhibition function and preparation and application thereof 轶诺(浙江)药业有限公司 2024-03-22 CN disclosed
WO-2022253328-A1 COMPOUND HAVING KINASE INHIBITORY FUNCTION, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 轶诺(浙江)药业有限公司 2022-12-08 WO disclosed
CN-115433161-A Novel HPK1 inhibitor and preparation method and application thereof 轶诺(浙江)药业有限公司 2022-12-06 CN disclosed
EP-2603500-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE F.HOFFMANN-LA ROCHE AG (CH) 2013-06-19 EP disclosed
WO-2012020008-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE F. HOFFMANN-LA ROCHE AG (CH) 2012-02-16 WO disclosed