SCHEMBL9532980

SCHEMBL9532980

CCCCC(=O)Nc1ccccc1C(=O)O

nearest known ligand 0.83

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.69
HPGD P15428 1/20 0.69
KDM4E B2RXH2 5/20 0.68
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
POLB P06746 3/20 0.65
ALDH1A1 P00352 2/20 0.65
CETP P11597 1/20 0.63
KMT2A Q03164 2/20 0.62
ATM Q13315 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
MEN1 O00255 1/20 0.60
LMNA P02545 1/20 0.60
TSHR P16473 1/20 0.60
SOAT1 P35610 2/20 0.58
HCAR2 Q8TDS4 1/20 0.58

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
SCHEMBL2183707 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL4139016 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL7629650 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL7634493 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL7636178 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL5840193 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL1042215 0.94 SOAT1 (0.68) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL7820705 0.91 CYP2C9 (0.71) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL2968441 0.90 KMT2A (0.66) CYP2C9HPGDKDM4ENPC1RAB9A
SCHEMBL24420606 0.87 CETP (0.63) CYP2C9HPGDKDM4ENPC1RAB9A

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-0525129-A4 SUBSTITUTED BENZIMIDAZOLES 1993-03-24 EP disclosed
EP-0525129-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-02-03 EP disclosed
WO-1991016313-A1 SUBSTITUTED BENZIMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1991-10-31 WO disclosed
EP-0425921-A1 Benzimidazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-05-08 EP disclosed