SCHEMBL4018747

SCHEMBL4018747

CC#Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(CC)n1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31

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
SCHEMBL4181101 0.86
SCHEMBL4018934 0.84 PDE2A (0.31)
SCHEMBL4025845 0.76 KDM4E (0.32) CYP11B1CYP11B2
SCHEMBL4018376 0.74 CYP19A1 (0.37)
SCHEMBL8188378 0.66 KMT2A (0.46) CYP11B1CYP11B2
SCHEMBL15649336 0.64 BRD4 (0.34) CYP11B1CYP11B2
SCHEMBL5447440 0.64 CYP19A1 (0.36) CYP11B1CYP11B2
SCHEMBL6366761 0.61 MEN1 (0.51)
SCHEMBL1423935 0.61 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL16125140 0.60 P2RX7 (0.34)

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
WO-2009093981-A1 TRIAZINE COMPOUNDS AS KINASE INHIBITORS S BIO PTE LTD (SG) 2009-07-30 WO disclosed
WO-2009093981-A1 TRIAZINE COMPOUNDS AS KINASE INHIBITORS S BIO PTE LTD (SG) 2009-07-30 WO disclosed