SCHEMBL9333002

SCHEMBL9333002

CCCC#Cc1ccc(C#Cc2ccc(-c3ccc(CCCC)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
HSD17B10 Q99714 1/20 0.53
FFAR1 O14842 2/20 0.51
FFAR4 Q5NUL3 2/20 0.51
RARB P10826 6/20 0.46
TNK2 Q07912 1/20 0.43
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RARA P10276 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 0.41
FDFT1 P37268 1/20 0.40
HSD11B1 P28845 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
GPR84 Q9NQS5 1/20 0.39
NISCH Q9Y2I1 1/20 0.39
HRH3 Q9Y5N1 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
SCHEMBL9332939 0.95 HSD17B10 (0.59) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9332573 0.95 FFAR1 (0.55) TSHRHSD17B10FFAR1FFAR4TNK2
SCHEMBL9333071 0.94 HSD17B10 (0.62) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9335897 0.94 HSD17B10 (0.62) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9333061 0.94 HSD17B10 (0.62) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9333588 0.93 FFAR1 (0.55) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9333029 0.90 FFAR1 (0.47) TSHRHSD17B10FFAR1FFAR4TNK2
SCHEMBL9332953 0.90 FFAR1 (0.57) TSHRHSD17B10FFAR1FFAR4TNK2
SCHEMBL28255947 0.89 HSD17B10 (0.62) TSHRHSD17B10FFAR1FFAR4RARB
SCHEMBL9332699 0.89 HSD17B10 (0.59) TSHRHSD17B10FFAR1FFAR4RARB

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
EP-0377516-B1 Liquid crystal compounds having high optical anisotropy CHISSO CORP (JP) 1994-05-04 EP disclosed
US-5154851-A LIQUID CRYSTAL COMPOUND HAVING LARGE OPTICAL ANISOTROPY VALUE CHISSO CORPORATION (JP) 1992-10-13 US disclosed
EP-0377516-A2 Liquid crystal compounds having high optical anisotropy Chisso Corporation (JP) 1990-07-11 EP disclosed