SCHEMBL30406151

SCHEMBL30406151

CCOC(=O)c1cn(C)cn1.CCSc1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nc(Br)n1C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ NOTUM Q6P988 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL29574039 0.85 — —
SCHEMBL20379039 0.85 — —
SCHEMBL23748057 0.78 — —
SCHEMBL30080303 0.78 — —
SCHEMBL20393619 0.77 ENPP1 (0.34) POLBKDM4EALDH1A1TP53
SCHEMBL20393615 0.75 POLB (0.33) POLBALDH1A1
SCHEMBL25658526 0.74 POLB (0.30) POLB
SCHEMBL30130672 0.73 KDM4E (0.35) POLBKDM4EALDH1A1TP53HPGD
SCHEMBL20393707 0.72 — —
SCHEMBL19148231 0.71 — —

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-3864015-B1 PROCESS FOR THE PREPARATION OF IMIDAZOLE DERIVATEIVES BAYER AG (DE) 2023-05-10 — — EP disclosed
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