SCHEMBL8958619

SCHEMBL8958619

Cc1nc(N(Cc2ccc(-c3ccccc3)c(C#N)c2)C(=O)C2CC2)c([N+](=O)[O-])c(C)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 19/20 0.40
XDH P47989 1/20 0.36

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
SCHEMBL8958490 0.91 NR1H4 (0.40) NR1H4XDH
SCHEMBL8872708 0.90 OXTR (0.37) NR1H4
SCHEMBL8958731 0.87 XDH (0.36) NR1H4XDH
SCHEMBL8958439 0.87 NR1H4 (0.40) NR1H4
SCHEMBL8958386 0.85 NR1H4 (0.40) NR1H4
SCHEMBL8873692 0.82 OXTR (0.37) NR1H4
SCHEMBL8873060 0.78 LTB4R2 (0.42) NR1H4
SCHEMBL8872980 0.78 OXTR (0.39) NR1H4
SCHEMBL8958402 0.78 XDH (0.36) NR1H4XDH
SCHEMBL8872195 0.77 NR1H4 (0.38) NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5559236-A Intermediates for substituted biphenylmethylmidazopyridine angiotensin II antagonists EISAI CO., LTD. (JP) 1996-09-24 US disclosed