SCHEMBL8621176

SCHEMBL8621176

CCCCCCc1ccc(-c2ccccc2)c(-c2cccc(C#N)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ CNR1 P21554 1/20 0.51
▸ CNR2 P34972 1/20 0.51
▸ GPR3 P46089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ PSMB5 P28074 1/20 0.43
▸ FAAH O00519 1/20 0.42
▸ LPL P06858 2/20 0.41
▸ LIPG Q9Y5X9 2/20 0.41
▸ CTSS P25774 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ RARB P10826 2/20 0.40
▸ HSD11B1 P28845 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADORA2B P29275 1/20 0.39

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
SCHEMBL3854170 0.99 CNR1 (0.49) TSHRHSD17B10CNR1CNR2GPR3
SCHEMBL11597170 0.90 TSHR (0.51) TSHRHSD17B10CNR1CNR2GPR3
SCHEMBL11572123 0.90 TSHR (0.65) TSHRHSD17B10GPR3PSMB5FAAH
SCHEMBL4603532 0.90 TSHR (0.65) TSHRHSD17B10GPR3PSMB5FAAH
SCHEMBL4605460 0.90 TSHR (0.65) TSHRHSD17B10GPR3PSMB5FAAH
SCHEMBL11730491 0.90 TSHR (0.65) TSHRHSD17B10GPR3PSMB5FAAH
SCHEMBL9632643 0.90 TSHR (0.65) TSHRHSD17B10GPR3PSMB5FAAH
SCHEMBL4651880 0.89 TSHR (0.49) TSHRHSD17B10CNR1CNR2GPR3
SCHEMBL4604750 0.88 TSHR (0.62) TSHRHSD17B10GPR3PSMB5RARB
SCHEMBL4651878 0.88 TSHR (0.62) TSHRHSD17B10GPR3PSMB5RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4069167-A 4-CYANO-4\"-N-ALKYLBI- AND TERPHENYLS, 4-CYANO-4\"-N-ALKOXYBIPHENYLS CHISSO CORPORATION (JA) 1978-01-17 — — US claimed
EP-0843197-A2 Liquid crystal device, display apparatus using same and display method using same CANON KABUSHIKI KAISHA (JP) 1998-05-20 — — EP disclosed
EP-0561389-B1 Display device, display apparatus using same and display method using same CANON KK (JP) 1997-01-29 — — EP disclosed
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