SCHEMBL8566940

SCHEMBL8566940

COc1cccc(C#N)c1-c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.51
CTSA P10619 5/20 0.43
ABL1 P00519 1/20 0.43
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
PGR P06401 2/20 0.40
PKM P14618 1/20 0.40
NAAA Q02083 1/20 0.40
IDO1 P14902 1/20 0.40
PRKCQ Q04759 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL28684149 0.86 AR (0.50) ARCTSAABL1POLBGAA
SCHEMBL7181751 0.85 AR (0.50) ARCTSAABL1POLBGAA
SCHEMBL942 0.84 TSHR (0.46) ARGAASMN1; SMN2
SCHEMBL1045908 0.82 TNKS (0.46) ARNAAA
SCHEMBL19608991 0.79 AR (0.49) ARCTSAPOLBGAAIMPDH2
SCHEMBL28641928 0.79 AR (0.49) ARCTSAPOLBGAAIMPDH2
SCHEMBL7636229 0.76 GRIA1 (0.52) ARGAASMN1; SMN2
SCHEMBL10536003 0.76 ALDH1A1 (0.46) ARGAASMN1; SMN2
SCHEMBL19608966 0.75 AR (0.49) ARPOLBGAAIMPDH2IMPDH1
SCHEMBL3255414 0.75 ALDH1A1 (0.47) ARCTSAABL1POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0598702-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1998-06-10 EP disclosed
EP-0628557-B1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same EISAI CO LTD (JP) 1997-05-02 EP disclosed
US-5506238-A HYPOTENSIVE AGENT EISAI CO., LTD. (JP) 1996-04-09 US disclosed
EP-0420237-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1996-03-06 EP disclosed
EP-0628557-A1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-12-14 EP disclosed
US-5328911-A Cardiovascular disorders, hypotensive agents and congestive heart failure EISAI CO., LTD. (JP) 1994-07-12 US disclosed
EP-0598702-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-05-25 EP disclosed
US-5298518-A Biphenylmethane derivative and pharmacological use EISAI CO., LTD. (JP) 1994-03-29 US disclosed
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP disclosed