SCHEMBL8563371

SCHEMBL8563371

Cc1ccc(-c2cc(Cl)ccc2C#N)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.48
MAOB P27338 1/20 0.48
AR P10275 1/20 0.46
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 4/20 0.42
HPGD P15428 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
PPARG P37231 1/20 0.42
STAT3 P40763 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
CNR1 P21554 2/20 0.41
VCAM1 P19320 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL8561261 0.86 XDH (0.47) MAOAMAOBARALDH1A1KDM4E
SCHEMBL22560836 0.85 AR (0.51) MAOAMAOBARALDH1A1KDM4E
SCHEMBL20241535 0.81 NPSR1 (0.50) MAOAMAOBALDH1A1KDM4EHPGD
SCHEMBL18406715 0.80 ALDH1A1 (0.54) MAOAMAOBARALDH1A1KDM4E
SCHEMBL8569201 0.78 MAOA (0.42) MAOAMAOBKDM4ECNR1VCAM1
SCHEMBL27259193 0.78 TAAR1 (0.49) MAOAMAOBCNR1VCAM1
SCHEMBL15832012 0.78 CYP19A1 (0.50) ARALDH1A1KDM4ENPSR1GAA
SCHEMBL26551722 0.77 AR (0.49) MAOAMAOBARALDH1A1KDM4E
SCHEMBL14684648 0.77 TSHR (0.47) MAOAMAOBALDH1A1KDM4EHPGD
SCHEMBL8567177 0.76 AR (0.54) MAOAMAOBARALDH1A1KDM4E

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