SCHEMBL18686169

SCHEMBL18686169

N#Cc1cnn2c(Nc3cccc(C(=O)O)c3)c(-c3ccc4c(c3)NC(=O)CO4)[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 1/20 0.39
▸ KMT2A Q03164 2/20 0.37
▸ NR3C2 P08235 3/20 0.36
▸ SYK P43405 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ GSK3B P49841 3/20 0.36
▸ PARP1 P09874 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PLK1 P53350 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 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
SCHEMBL2122405 0.92 CYP2C9 (0.37) KMT2ANR3C2SYKGAALMNA
SCHEMBL2123123 0.89 NR3C2 (0.40) KMT2ANR3C2SYKPARP1RXFP1
SCHEMBL2123293 0.89 CSNK2A1 (0.42) CSNK2A1KMT2ANR3C2SYKALDH1A1
SCHEMBL2124835 0.85 NR3C2 (0.39) KMT2ANR3C2SYKGAAALDH1A1
SCHEMBL2125808 0.85 ALDH1A1 (0.38) CSNK2A1KMT2ANR3C2GAALMNA
SCHEMBL18686162 0.84 KMT2A (0.39) KMT2ANR3C2GAALMNAALDH1A1
SCHEMBL2125865 0.84 NR3C2 (0.39) KMT2ANR3C2SYKGAAALDH1A1
SCHEMBL2124521 0.81 MAPT (0.41) KMT2ANR3C2SYKGAAALDH1A1
SCHEMBL2123296 0.81 SYK (0.43) KMT2ANR3C2SYKGAAALDH1A1
SCHEMBL2124567 0.80 SYK (0.42) KMT2ANR3C2SYKGAALMNA

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-2443123-B1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS INC (US) 2017-04-05 — — EP claimed
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