SCHEMBL23601152

SCHEMBL23601152

Cc1ccc(F)c(-c2cnc(C3CC3)cn2)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.40
PIM1 P11309 2/20 0.38
TGFBR1 P36897 8/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM1A O60341 2/20 0.35
PDE10A Q9Y233 2/20 0.34
DHODH Q02127 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL24721550 0.81 ALOX5AP (0.37) KDM1APDE10AALOX5APFEN1
SCHEMBL23601157 0.76 AURKA (0.42) PIM1PDE10A
SCHEMBL17408899 0.73 TGFBR1 (0.37) NISCHPIM1TGFBR1DHODH
SCHEMBL23601165 0.73 FEN1 (0.41) ALOX5APFEN1
SCHEMBL8360921 0.72 DHODH (0.43) NISCHPIM1TGFBR1KDM1ADHODH
SCHEMBL23601694 0.72 KDM1A (0.50) NISCHKDM1A
SCHEMBL23601162 0.71 CYP11B1 (0.34) PIM1KDM1APDE10A
SCHEMBL16502032 0.70 PTGS2 (0.40) NISCHPIM1TGFBR1KDM1ADHODH
SCHEMBL14988315 0.70 KDM1A (0.43) NISCHPIM1TGFBR1KDM1ADHODH
SCHEMBL24721358 0.70 ALOX5AP (0.38) KDM1AALOX5APFEN1

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
WO-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO disclosed