SCHEMBL21533361

SCHEMBL21533361

C[C@]1(C(F)(F)F)CCCC(Cn2cnc(N)c2)C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.32
▸ CPB2 Q96IY4 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
Hydrochloric Acid SCHEMBL23389293 0.74 KDM4C (0.44) KDM4CCPB2
Hydrochloric Acid SCHEMBL23389331 0.74 CPB2 (0.43) KDM4CCPB2
SCHEMBL22854663 0.72 PHF8 (0.45) KDM4CCPB2
Hydrochloric Acid SCHEMBL22833576 0.70 PHF8 (0.44) KDM4CCPB2
Hydrochloric Acid SCHEMBL23389343 0.70 PHF8 (0.44) KDM4CCPB2
SCHEMBL19601356 0.66 APLNR (0.34) —
SCHEMBL21758907 0.61 — —
SCHEMBL19402274 0.61 KDM4C (0.40) KDM4CCPB2
SCHEMBL1396149 0.61 KDM2B (0.44) —
SCHEMBL24936210 0.60 KDM4C (0.39) KDM4CCPB2

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-3560494-A1 DRUG TARGETING CANCER STEM CELL Sumitomo Dainippon Pharma Co., Ltd. (JP) 2019-10-30 — — EP disclosed
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