SCHEMBL8958444

SCHEMBL8958444

Cc1c(Cl)cnc(NC(=O)C2CC2Cc2ccc(-c3ccccc3)c(C#N)c2)c1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 2/20 0.37
BCL2 P10415 1/20 0.35
MCL1 Q07820 1/20 0.35
GRM5 P41594 1/20 0.34
MAP4K1 Q92918 9/20 0.34
FFAR4 Q5NUL3 1/20 0.33
CD274 Q9NZQ7 1/20 0.32
ABL1 P00519 2/20 0.32
CTSA P10619 1/20 0.32
XDH P47989 1/20 0.32

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
SCHEMBL8958388 0.91 WNT3A (0.37) WNT3ABCL2MCL1GRM5MAP4K1
SCHEMBL8872200 0.91 ABL1 (0.38) BCL2MCL1MAP4K1FFAR4ABL1
SCHEMBL8958623 0.88 LMNA (0.36) WNT3ABCL2MCL1GRM5MAP4K1
SCHEMBL8958497 0.85 LMNA (0.36) WNT3ABCL2MCL1GRM5MAP4K1
SCHEMBL8949946 0.83 ABL1 (0.39) MAP4K1ABL1
SCHEMBL8872938 0.81 ABL1 (0.38) BCL2MCL1MAP4K1ABL1
SCHEMBL8879710 0.80 BDKRB1 (0.39)
SCHEMBL8872711 0.79 LMNA (0.35) BCL2MCL1ABL1
SCHEMBL8958439 0.78 NR1H4 (0.40)
SCHEMBL8874542 0.77 BDKRB1 (0.39) MAP4K1ABL1

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