SCHEMBL17383741

SCHEMBL17383741

CCc1cc(NC2COC2)nc(C(C)(C)C)n1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.31
▸ CCNT1 O60563 1/20 0.30
▸ CDK9 P50750 1/20 0.30
▸ HRH3 Q9Y5N1 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
SCHEMBL15830004 0.83 HRH3 (0.36) ESR1HRH3
SCHEMBL17300821 0.81 HMGCR (0.33) CCNT1CDK9
SCHEMBL17303787 0.81 KCNN2 (0.35) CCNT1CDK9
SCHEMBL19957822 0.81 ESR1 (0.33) ESR1CCNT1CDK9HRH3
SCHEMBL15833954 0.77 CCNT1 (0.46) CCNT1CDK9HRH3
SCHEMBL21064102 0.77 CCNT1 (0.38) ESR1CCNT1CDK9HRH3
SCHEMBL15834078 0.77 RXRA (0.32) ESR1CCNT1CDK9HRH3
SCHEMBL19957555 0.77 CCNT1 (0.33) ESR1CCNT1CDK9HRH3
SCHEMBL17300764 0.74 CCNT1 (0.30) CCNT1CDK9
SCHEMBL17306652 0.74 PTGS2 (0.31) ESR1CCNT1CDK9HRH3

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
WO-2015200677-A2 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-30 — — WO disclosed
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