SCHEMBL29909772

SCHEMBL29909772

CN(c1cccc(-c2ccc(Cl)cc2)c1)c1nc2nncn2c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
MAPT P10636 3/20 0.39
TP53 P04637 2/20 0.39
POLB P06746 1/20 0.39
ABCG2 Q9UNQ0 2/20 0.38
PDE5A O76074 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL23576825 1.00 FNTA (0.40) FNTAFNTBMAPTTP53POLB
SCHEMBL23578033 0.92 PDE5A (0.44) POLBABCG2PDE5ASMN1; SMN2TSHR
SCHEMBL29909768 0.92 FNTA (0.40) FNTAFNTBMAPTTP53POLB
SCHEMBL23601235 0.92 FNTA (0.40) FNTAFNTBMAPTTP53POLB
SCHEMBL23578009 0.90 ALDH1A1 (0.39) MAPTTP53POLBABCG2PDE5A
SCHEMBL29909882 0.90 ALDH1A1 (0.39) MAPTTP53POLBABCG2PDE5A
SCHEMBL30920925 0.89 TP53 (0.39) FNTAFNTBMAPTTP53POLB
SCHEMBL23576621 0.89 ABCG2 (0.45) MAPTTP53ABCG2PDE5ASMN1; SMN2
SCHEMBL23577687 0.89 ABCG2 (0.38) MAPTABCG2PDE5ASMN1; SMN2TSHR
SCHEMBL29909029 0.89 ABCG2 (0.45) MAPTTP53ABCG2PDE5ASMN1; SMN2

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-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed