SCHEMBL4333030

SCHEMBL4333030

CC(=O)Oc1c(Cl)nc(Cc2ccc(N)cc2)n2ccnc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ZAP70 P43403 6/20 0.31
KARS1 Q15046 6/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALK Q9UM73 5/20 0.30
SYK P43405 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
SCHEMBL13236205 0.79 NPSR1 (0.37) KMT2ARXFP1KDM4EHPGDSMN1; SMN2
SCHEMBL5959166 0.79 KMT2A (0.34) KMT2ARXFP1ZAP70KARS1SYK
SCHEMBL2942781 0.78 PTGDR2 (0.36) KMT2ARXFP1KDM4EHPGDSMN1; SMN2
SCHEMBL6016955 0.75 DHPS (0.42) KMT2ARXFP1KDM4EHPGDSMN1; SMN2
SCHEMBL12415747 0.69 TLR7 (0.34) KMT2ARXFP1ZAP70KARS1ALK
SCHEMBL6016956 0.68 DHPS (0.37) RXFP1KDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL13236218 0.68 ALDH1A1 (0.37) KMT2ARXFP1ZAP70KARS1SYK
SCHEMBL2945205 0.67 GABRP (0.38) KMT2ARXFP1KDM4EHPGDZAP70
SCHEMBL13264544 0.67 L3MBTL1 (0.32) KDM4ENPSR1ALK
SCHEMBL1923032 0.65 PTGDR2 (0.39) KMT2ASMN1; SMN2NPSR1

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-1718649-B1 IMIDAZO 1,2-C PYRIMIDINYLACETIC ACID DERIVATIVES ACTIMIS PHARMACEUTICALS INC (US) 2009-06-10 EP disclosed