SCHEMBL9870474

SCHEMBL9870474

CCCCSc1sc(=S)sc1SCCCC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
USP2 O75604 1/20 0.38
ALDH1A1 P00352 3/20 0.35
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
KDM4E B2RXH2 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL2562514 0.93 ALDH1A1 (0.42) HSD17B10CYP1A2CYP3A4CYP2C19USP2
SCHEMBL1654430 0.91 ALDH1A1 (0.44) HSD17B10CYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL11714286 0.71 ALDH1A1 (0.32) HSD17B10CYP1A2CYP2C19USP2ALDH1A1
SCHEMBL2559443 0.67 HSD17B10 (0.41) HSD17B10CYP1A2CYP3A4CYP2C19ALDH1A1
SCHEMBL10692695 0.66 USP2 (0.43) USP2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL11719908 0.66 ALDH1A1 (0.38) CYP1A2CYP2C19ALDH1A1NPC1RAB9A
SCHEMBL11718129 0.66 ALDH1A1 (0.38) CYP1A2CYP2C19ALDH1A1NPC1RAB9A
SCHEMBL10797194 0.65 ALDH1A1 (0.63) HSD17B10USP2ALDH1A1NPC1RAB9A
SCHEMBL6361818 0.61 ALDH1A1 (0.58) USP2ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2253336 0.60 TLR8 (0.42) USP2ALDH1A1NPC1RAB9AKDM4E

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
US-5024923-A Sulfur-containing metal complex FUJI PHOTO FILM CO., LTD. (JP) 1991-06-18 US disclosed