SCHEMBL4637526

SCHEMBL4637526

CCOC(=O)C1CCC(c2ccc(F)cc2)N1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 12/20 0.56
SCN3A Q9NY46 8/20 0.44
SCN1A P35498 1/20 0.44
SCN4A P35499 1/20 0.44
SCN7A Q01118 1/20 0.44
SCN5A Q14524 1/20 0.44
SCN9A Q15858 1/20 0.44
SCN2A Q99250 1/20 0.44
SCN8A Q9UQD0 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2B6 P20813 1/20 0.43
MAOB P27338 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL3585032 1.00 KCNH2 (0.56) KCNH2SCN3ASCN1ASCN4ASCN7A
SCHEMBL4637528 1.00 KCNH2 (0.56) KCNH2SCN3ASCN1ASCN4ASCN7A
SCHEMBL3585037 1.00 KCNH2 (0.56) KCNH2SCN3ASCN1ASCN4ASCN7A
SCHEMBL2350627 1.00 KCNH2 (0.56) KCNH2SCN3ASCN1ASCN4ASCN7A
SCHEMBL14740679 0.92 KCNH2 (0.48) KCNH2SCN3AALDH1A1TDP1MEN1
SCHEMBL2346176 0.86 MEN1 (0.47) KCNH2SCN3ASCN9AALDH1A1MEN1
SCHEMBL28908009 0.86 KCNH2 (0.41) KCNH2SCN3ASCN1ASCN4ASCN7A
SCHEMBL3600450 0.86 ALDH1A1 (0.51) KCNH2SCN3ACYP1A2CYP2C19ALDH1A1
SCHEMBL28521573 0.86 ALDH1A1 (0.51) KCNH2SCN3ACYP1A2CYP2C19ALDH1A1
SCHEMBL3600447 0.86 ALDH1A1 (0.51) KCNH2SCN3ACYP1A2CYP2C19ALDH1A1

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-3889138-B1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF HINOVA PHARMACEUTICALS INC (CN) 2024-11-20 EP disclosed
CN-111217802-B Histone acetylase p300 inhibitor and application thereof 海创药业股份有限公司 2021-10-08 CN disclosed
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed
CN-111217802-A Histone acetylase p300 inhibitor and application thereof 成都海创药业有限公司 2020-06-02 CN disclosed
EP-1937663-A1 THIOPHENE DERIVATIVES AS PPAR AGONISTS I Inpharmatica Limited (GB) 2008-07-02 EP disclosed
WO-2007036730-A9 THIOPHENE DERIVATIVES AS PPAR AGONISTS I INPHARMATICA LTD (GB) 2008-06-19 WO disclosed
WO-2007036730-A1 THIOPHENE DERIVATIVES AS PPAR AGONISTS I INPHARMATICA LIMITED (GB) 2007-04-05 WO disclosed