SCHEMBL29909787

SCHEMBL29909787

CN(c1cccc(-c2ccc(C3(CO)CC3)cc2)c1)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
MAT2A P31153 4/20 0.32
HTT P42858 1/20 0.32
TACR1 P25103 1/20 0.32
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
MCHR1 Q99705 1/20 0.31
PRMT5 O14744 1/20 0.31
CYP1A2 P05177 1/20 0.31
HSD11B1 P28845 2/20 0.30
PRKAB2 O43741 1/20 0.30
PRKAG1 P54619 1/20 0.30
PRKAA2 P54646 1/20 0.30
PRKAA1 Q13131 1/20 0.30
PRKAG3 Q9UGI9 1/20 0.30
PRKAG2 Q9UGJ0 1/20 0.30
PRKAB1 Q9Y478 1/20 0.30
POLB P06746 1/20 0.30
DRD2 P14416 1/20 0.30

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
SCHEMBL23578133 1.00 FNTA (0.33) FNTAFNTBMAT2AHTTTACR1
SCHEMBL29909830 0.92 FNTA (0.34) FNTAFNTBMAT2ATP53MAPT
SCHEMBL23576674 0.92 SLC6A4 (0.35) FNTAFNTBMAT2ATP53MAPT
SCHEMBL23577586 0.92 FNTA (0.34) FNTAFNTBMAT2ATP53MAPT
SCHEMBL29909769 0.92 SLC6A4 (0.35) FNTAFNTBMAT2ATP53MAPT
SCHEMBL23576631 0.88 MCHR1 (0.39) MCHR1
SCHEMBL29909768 0.87 FNTA (0.40) FNTAFNTBMAT2AHTTTP53
SCHEMBL23601235 0.87 FNTA (0.40) FNTAFNTBMAT2AHTTTP53
SCHEMBL23600995 0.85 FNTA (0.34) FNTAFNTBMAT2AHSD11B1
SCHEMBL31229443 0.85 FNTA (0.34) FNTAFNTBMAT2AHSD11B1

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