SCHEMBL20197270

SCHEMBL20197270

CCCc1cc(-c2nc(-c3ccc(NSC(F)(F)F)cc3C(F)(F)F)cs2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SREBF2 Q12772 17/20 0.53
SREBF1 P36956 1/20 0.52
MAPT P10636 3/20 0.50
ATM Q13315 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 1/20 0.50
KDM4E B2RXH2 2/20 0.49
LMNA P02545 2/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL20197269 0.90 SREBF2 (0.56) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197221 0.89 SREBF2 (0.55) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197300 0.86 SREBF2 (0.67) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL16548497 0.84 SREBF2 (0.59) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197352 0.81 SREBF2 (0.59) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197249 0.80 SREBF2 (0.43) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL22152727 0.77 SREBF2 (0.43) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197178 0.77 SREBF2 (0.61) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197299 0.77 SREBF2 (0.61) SREBF2SREBF1MAPTATML3MBTL1
SCHEMBL20197360 0.76 SREBF2 (0.48) SREBF2SREBF1MAPTATMALDH1A1

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-3038622-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECH LLC (US) 2018-05-30 EP disclosed