SCHEMBL29909000

SCHEMBL29909000

CC#Cc1ccc2c(N(C)c3ccccc3)nc3nncn3c2c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP1B1 Q16678 1/20 0.39
PDE5A O76074 2/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CSNK2A1 P68400 2/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL23577064 1.00 CYP1A1 (0.39) CYP1A1CYP1A2CYP1B1PDE5AABCG2
SCHEMBL23601201 0.92 GRM5 (0.36) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1
SCHEMBL23601182 0.90 PDE5A (0.33) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1
SCHEMBL23577272 0.88 ABCG2 (0.32) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1
SCHEMBL29909592 0.88 ABCG2 (0.32) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1
SCHEMBL23600546 0.88 ALOX15 (0.33) CYP1A2PDE5AABCG2MAPTSMN1; SMN2
SCHEMBL23601418 0.88 PDE5A (0.34) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1
SCHEMBL23601193 0.88 ABCG2 (0.44) CYP1A2PDE5AABCG2MAPTSMN1; SMN2
SCHEMBL23576696 0.87 CYP1A2 (0.33) CYP1A2PDE5AABCG2MAPTSMN1; SMN2
SCHEMBL23577025 0.87 SLC6A4 (0.34) PDE5AABCG2MAPTSMN1; SMN2CSNK2A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4081305-B1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES INC (JP) 2024-09-18 EP disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed