SCHEMBL6446595

SCHEMBL6446595

CCCCc1c(C(=O)O)oc2ccccc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 5/20 0.54
BCL2 P10415 1/20 0.54
BCL2L1 Q07817 1/20 0.54
BAD Q92934 1/20 0.54
TSHR P16473 1/20 0.47
APEX1 P27695 1/20 0.47
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PTPN1 P18031 1/20 0.45
EYA3 Q99504 1/20 0.45
PLK1 P53350 1/20 0.45
TTR P02766 1/20 0.45

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
SCHEMBL3839733 0.96 MCL1 (0.53) MCL1BCL2BCL2L1BADTSHR
SCHEMBL11416328 0.92 MCL1 (0.52) MCL1BCL2BCL2L1BADTSHR
SCHEMBL4672754 0.90 MCL1 (0.65) MCL1BCL2BCL2L1BADTSHR
SCHEMBL5273001 0.85 CAPN1 (0.56) MCL1BCL2BCL2L1BADTSHR
SCHEMBL13015569 0.81 KCNA3 (0.51) MCL1BCL2BCL2L1BADMEN1
SCHEMBL11179425 0.80 MCL1 (0.51) MCL1BCL2BCL2L1BADTSHR
SCHEMBL18415631 0.78 PTPN1 (0.61) PTPN1EYA3TTR
SCHEMBL6045428 0.77 TTR (0.52) MCL1TSHRMAPK1MEN1KMT2A
SCHEMBL2773751 0.77 MCL1 (0.58) MCL1BCL2BCL2L1BADTSHR
SCHEMBL29587413 0.77 TTR (0.52) MCL1TSHRMAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606278-A1 SUBSTITUTED CYCLOHEXYL AND PIPERIDINYL DERIVATES AS MELANOCORTIN-4 RECEPTOR MODULATORS Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2005-12-21 EP disclosed
EP-1603912-A1 SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2005-12-14 EP disclosed
WO-2004083209-A1 SUBSTITUTED PIPERIDINE AND PIPERAZINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2004-09-30 WO disclosed
WO-2004083198-A1 SUBSTITUTED CYCLOHEXYL AND PIPERIDINYL DERIVATES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2004-09-30 WO disclosed