SCHEMBL8569201

SCHEMBL8569201

N#Cc1ccc(Cl)cc1-c1ccc(CBr)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CYP19A1 P11511 3/20 0.41
CNR1 P21554 12/20 0.41
CNR2 P34972 3/20 0.40
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
VCAM1 P19320 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ABL1 P00519 1/20 0.38

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
SCHEMBL27259193 0.84 TAAR1 (0.49) MAOAMAOBCYP19A1CNR1PRMT5
SCHEMBL21083705 0.82 CYP19A1 (0.43) MAOAMAOBCYP19A1
SCHEMBL14684648 0.79 TSHR (0.47) MAOAMAOBCYP19A1KDM4E
SCHEMBL8563371 0.78 MAOA (0.48) MAOAMAOBCNR1CNR2VCAM1
SCHEMBL20241535 0.78 NPSR1 (0.50) MAOAMAOBCYP19A1CNR1VCAM1
SCHEMBL8155256 0.77 CYP19A1 (0.55) MAOAMAOBCYP19A1KDM4ETDP1
SCHEMBL29175248 0.76 CYP19A1 (0.46) CYP19A1CNR1
SCHEMBL357 0.76 ESR2 (0.59) CYP19A1CNR2
SCHEMBL31772593 0.76 ESR2 (0.59) CYP19A1CNR2
SCHEMBL6756395 0.75 AHR (0.53) CNR1

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