SCHEMBL29625913

SCHEMBL29625913

COc1ccc(-n2c(=O)[nH]c(=O)n(-c3ccc(Oc4ccccc4)c(C)c3)c2=O)cc1

nearest known ligand 0.86

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 15/20 0.86
NTRK2 Q16620 15/20 0.86
IGF1R P08069 5/20 0.86
FGFR1 P11362 5/20 0.86
NTRK3 Q16288 11/20 0.65
ATM Q13315 1/20 0.49
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
BCAT2 O15382 1/20 0.43
BCAT1 P54687 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL23051394 1.00 NTRK1 (0.86) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21295396 0.93 NTRK1 (0.86) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL30743944 0.93 NTRK1 (0.86) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21295407 0.93 NTRK1 (1.00) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL30743942 0.93 NTRK1 (0.95) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21305495 0.93 NTRK1 (0.95) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21295434 0.90 NTRK1 (0.90) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21295416 0.89 NTRK1 (0.91) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL21300482 0.88 NTRK1 (0.86) NTRK1NTRK2IGF1RFGFR1NTRK3
SCHEMBL30744039 0.88 NTRK1 (0.86) NTRK1NTRK2IGF1RFGFR1NTRK3

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
CN-114423743-A Triazine derivatives for the treatment of diseases associated with neurotrophic factors 阿泽克制药公司 2022-04-29 CN disclosed