SCHEMBL9537112

SCHEMBL9537112

COC(=O)C(N)CC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 14/20 0.53
MDM4 O15151 1/20 0.45
MDM2 Q00987 1/20 0.45
KCNN4 O15554 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL29050926 1.00 KIF11 (0.53) KIF11MDM4MDM2KCNN4KMT2A
SCHEMBL3184027 0.84 KIF11 (0.51) KIF11KCNN4KMT2A
SCHEMBL3184012 0.84 KIF11 (0.51) KIF11KCNN4KMT2A
Bromide SCHEMBL1200794 0.83 KIF11 (0.50) KIF11KCNN4KMT2A
Bromide SCHEMBL1200791 0.83 KIF11 (0.50) KIF11KCNN4KMT2A
SCHEMBL29053899 0.80 KIF11 (0.68) KIF11
SCHEMBL29053902 0.80 KIF11 (0.68) KIF11
SCHEMBL31503681 0.78 KIF11 (0.51) KIF11KCNN4KMT2A
SCHEMBL12872399 0.76 KIF11 (0.85) KIF11
SCHEMBL3439368 0.76 KIF11 (0.85) KIF11

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
EP-0535192-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME. HOFFMANN LA ROCHE (CH) 1993-04-07 EP disclosed