SCHEMBL6667232

SCHEMBL6667232

CSc1ccc(-c2ccccc2)c(C(=O)Nc2ccc3c(c2)CCN3C(=O)Cc2cccc(-n3c(C)ccc3C)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.39
EIF2AK3 Q9NZJ5 2/20 0.39
MAPT P10636 7/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
CREBBP Q92793 1/20 0.37
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
PDE7A Q13946 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35

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
SCHEMBL6806327 0.92 EIF2AK3 (0.41) RIPK1EIF2AK3MAPTKMT2AKDM4E
SCHEMBL6665768 0.91 MAPT (0.41) RIPK1EIF2AK3MAPTKMT2AKDM4E
SCHEMBL6666848 0.89 TP53 (0.39) RIPK1EIF2AK3MAPTKMT2AMEN1
SCHEMBL6668213 0.89 AVPR2 (0.42) RIPK1EIF2AK3MAPTKDM4EALDH1A1
SCHEMBL6662998 0.88 EIF2AK3 (0.42) RIPK1EIF2AK3MAPTKMT2AKDM4E
SCHEMBL6666513 0.88 MTTP (0.40) RIPK1EIF2AK3MAPTHTR2AHTR2C
SCHEMBL6804990 0.86 MAPT (0.44) RIPK1EIF2AK3MAPTCREBBPNPC1
SCHEMBL6668674 0.86 EIF2AK3 (0.46) EIF2AK3MAPTKMT2AKDM4EMEN1
SCHEMBL6664419 0.84 HTR2A (0.41) RIPK1EIF2AK3MAPTHTR2AHTR2C
SCHEMBL6803618 0.84 RIPK1 (0.40) RIPK1EIF2AK3MAPTKMT2AMEN1

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