SCHEMBL28322841

SCHEMBL28322841

CCCCCc1sc(CCCCC)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.46
▸ CNR1 P21554 1/20 0.46
▸ PTPN1 P18031 1/20 0.44
▸ MAPT P10636 2/20 0.42
▸ TLR8 Q9NR97 1/20 0.42
▸ TLR7 Q9NYK1 1/20 0.42
▸ KCNH2 Q12809 3/20 0.42
▸ LIPG Q9Y5X9 1/20 0.41
▸ CTSV O60911 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ATM Q13315 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL16976880 0.87 CNR2 (0.41) CNR2CNR1PTPN1MAPTTLR8
SCHEMBL12270392 0.81 CNR2 (0.40) CNR2CNR1PTPN1MAPTTLR8
SCHEMBL16405013 0.81 CNR2 (0.38) CNR2CNR1PTPN1MAPTTLR8
SCHEMBL6060597 0.77 CNR2 (0.52) CNR2CNR1PTPN1KDM4EALDH1A1
SCHEMBL4429817 0.76 CNR2 (0.51) CNR2CNR1PTPN1MAPTKCNH2
SCHEMBL11205839 0.76 PTPN1 (0.57) CNR2CNR1PTPN1KDM4EALDH1A1
SCHEMBL6911529 0.76 CNR2 (0.54) CNR2CNR1PTPN1MAPTTLR8
SCHEMBL11210513 0.76 LOXL2 (0.59) CNR2CNR1PTPN1MAPTALDH1A1
SCHEMBL31229334 0.76 CNR2 (0.51) CNR2CNR1PTPN1TLR8KDM4E
SCHEMBL10450091 0.76 CNR2 (0.51) CNR2CNR1PTPN1TLR8KDM4E

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
CN-110325377-A Pneumatic tire 株式会社普利司通 2019-10-11 — — CN disclosed
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