SCHEMBL8814928

SCHEMBL8814928

Cc1ccc(-c2ccccc2)c(C(=O)Nc2ccc(C(=O)N(C)c3ccc(Cl)cc3O)c(Cl)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
TMPRSS4 Q9NRS4 2/20 0.42
GPR27 Q9NS67 1/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
NR1H4 Q96RI1 1/20 0.41
P2RX1 P51575 1/20 0.41
CYP2C19 P33261 1/20 0.41
PLAU P00749 1/20 0.41
PNLIP P16233 1/20 0.40
LMNA P02545 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
SCHEMBL7377166 0.90 AVPR2 (0.48) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL8814391 0.89 POLB (0.46) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL8812976 0.86 MEN1 (0.51) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL8816546 0.86 CYP19A1 (0.45) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL8812526 0.83 GCGR (0.40) MEN1KMT2AL3MBTL1TP53MAPT
SCHEMBL8812136 0.83 SMN1; SMN2 (0.46) NPC1RAB9ATP53PPARGPPARA
SCHEMBL8813752 0.80 KCNMA1 (0.49) NPC1MEN1KMT2ATP53MAPT
SCHEMBL7367409 0.79 HTT (0.47) NPC1MEN1KMT2AL3MBTL1MAPT
SCHEMBL7376165 0.79 AVPR2 (0.48) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL7512593 0.77 CYP19A1 (0.45) NPC1RAB9AMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757670-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed