SCHEMBL27005607

SCHEMBL27005607

COc1ccc(-c2sc(C)cc2-c2ccc(C#N)c(F)c2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 12/20 0.47
XDH P47989 1/20 0.44
CYP11B1 P15538 4/20 0.43
CYP11B2 P19099 4/20 0.43
PGR P06401 1/20 0.40
AR P10275 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL27005639 0.84 KDM1A (0.46) KDM1AXDHCYP11B1CYP11B2SCN9A
SCHEMBL27005505 0.84 KDM1A (0.44) KDM1AXDHCYP11B1CYP11B2PGR
SCHEMBL27005911 0.83 XDH (0.38) KDM1AXDHCYP11B1CYP11B2PGR
SCHEMBL27005481 0.83 XDH (0.49) KDM1AXDHPGRAR
SCHEMBL27005050 0.82 ESR1 (0.48) CYP11B1CYP11B2AR
SCHEMBL27005480 0.81 PRKCZ (0.51) KDM1AXDH
SCHEMBL27005774 0.78 KDM1A (0.48) KDM1ACYP11B1CYP11B2
SCHEMBL27004984 0.77 KDM1A (0.55) KDM1A
SCHEMBL27005844 0.77 CYP11B1 (0.45) CYP11B1CYP11B2
SCHEMBL27009752 0.75 CYP11B1 (0.45) KDM1ACYP11B1CYP11B2

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