SCHEMBL20197263

SCHEMBL20197263

CC(C)Cc1cc(-c2nc(-c3cccc(NSC(F)(F)F)c3)cs2)ccn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SREBF2 Q12772 15/20 0.47
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.43
SREBF1 P36956 2/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL20197347 0.89 SREBF2 (0.55) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL22152727 0.84 SREBF2 (0.43) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL20197323 0.84 SREBF2 (0.46) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL20197208 0.84 SREBF2 (0.43) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL16535189 0.83 SREBF2 (0.47) SREBF2MAPTSMN1; SMN2HTTKDM4E
SCHEMBL20197360 0.83 SREBF2 (0.48) SREBF2MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL20197405 0.81 SREBF2 (0.42) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL16544537 0.80 SREBF2 (0.60) SREBF2MAPTSMN1; SMN2HTTKDM4E
SCHEMBL20197194 0.77 SREBF2 (0.39) SREBF2MAPTKDM4ESREBF1ALDH1A1
SCHEMBL20197300 0.76 SREBF2 (0.67) SREBF2MAPTKDM4ESREBF1ALDH1A1

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