SCHEMBL27005247

SCHEMBL27005247

COc1ccc(-c2sc(C(=O)N3CCC[C@@H](N(C)C)C3)cc2-c2ccc(C#N)c(F)c2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 19/20 0.51
ALDH1A1 P00352 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
SCHEMBL27004987 1.00 KDM1A (0.51) KDM1AALDH1A1
SCHEMBL27004979 0.95 KDM1A (0.50) KDM1A
SCHEMBL27005245 0.95 KDM1A (0.50) KDM1A
SCHEMBL27005601 0.91 KDM1A (0.61) KDM1A
SCHEMBL27005274 0.91 KDM1A (0.52) KDM1AALDH1A1
SCHEMBL27004934 0.91 KDM1A (0.61) KDM1A
SCHEMBL27005197 0.91 KDM1A (0.61) KDM1A
SCHEMBL27005027 0.91 KDM1A (0.52) KDM1AALDH1A1
SCHEMBL27005539 0.89 KDM1A (0.51) KDM1A
SCHEMBL27004966 0.89 KDM1A (0.59) KDM1A

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-4306520-A1 THIOPHENE COMPOUND AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2024-01-17 EP disclosed