SCHEMBL8621174

SCHEMBL8621174

CCCCCCc1ccc(-c2ccc(C#N)cc2-c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.65
HSD17B10 Q99714 1/20 0.65
RARB P10826 8/20 0.47
HSD11B1 P28845 2/20 0.47
GPR3 P46089 1/20 0.43
RARA P10276 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
MTOR P42345 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
HTR2A P28223 1/20 0.42
KCNH2 Q12809 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
RARG P13631 1/20 0.40

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
SCHEMBL11339892 1.00 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL11585374 1.00 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL10606870 1.00 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL7208756 0.99 TSHR (0.62) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL3854168 0.99 TSHR (0.62) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL9632643 0.92 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL4603532 0.92 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL11572123 0.92 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL11730491 0.92 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3
SCHEMBL4605460 0.92 TSHR (0.65) TSHRHSD17B10RARBHSD11B1GPR3

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