SCHEMBL6670249

SCHEMBL6670249

Cc1ccc(-c2ccccc2)c(C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2csc(N)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.42
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
TP53 P04637 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GFER P55789 1/20 0.41
CASP3 P42574 1/20 0.41
CASP2 P42575 1/20 0.41
EIF2AK3 Q9NZJ5 3/20 0.41
EIF2AK1 Q9BQI3 2/20 0.41
POLB P06746 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
SCHEMBL6803455 0.92 MAPT (0.44) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6664644 0.90 AVPR2 (0.44) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6669291 0.90 MAPT (0.48) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6665119 0.88 EIF2AK3 (0.44) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6667516 0.87 TP53 (0.42) MAPTNPC1RAB9ASMN1; SMN2TP53
Hydrochloric Acid SCHEMBL6667512 0.87 EIF2AK3 (0.43) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6671845 0.86 CYP11B1 (0.43) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6667068 0.86 MAPT (0.43) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6808866 0.85 SLC12A2 (0.46) MAPTNPC1RAB9ASMN1; SMN2TP53
SCHEMBL6664878 0.85 EIF2AK3 (0.48) MAPTNPC1RAB9ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed