SCHEMBL8565215

SCHEMBL8565215

CSc1nc2c(C)c(N)cnc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.37
AGTR2 P50052 4/20 0.37
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8563430 0.91 AGTR1 (0.38) AGTR1AGTR2MAPK1MEN1KMT2A
SCHEMBL8971906 0.89 PDE10A (0.41) AGTR1AGTR2MEN1KMT2A
SCHEMBL9311939 0.88 TLR7 (0.39) AGTR1AGTR2
SCHEMBL8971527 0.86 AGTR1 (0.37) AGTR1AGTR2MEN1KMT2A
SCHEMBL8972563 0.85 AGTR1 (0.53) AGTR1AGTR2MEN1KMT2A
SCHEMBL9847779 0.85 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9053246 0.84 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL8971629 0.84 AGTR1 (0.41) AGTR1AGTR2MEN1KMT2A
Ammonia Solution, Strong SCHEMBL8565223 0.84 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8972001 0.84 MEN1 (0.52) AGTR1AGTR2MEN1KMT2A

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 6 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
US-5506238-A HYPOTENSIVE AGENT EISAI CO., LTD. (JP) 1996-04-09 US 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