SCHEMBL19957555

SCHEMBL19957555

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ MAP3K12 Q12852 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ HRH3 Q9Y5N1 2/20 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
SCHEMBL19633485 0.87 EHMT2 (0.35) CCNT1CDK9ESR1
SCHEMBL15833953 0.85 EHMT2 (0.35) CCNT1CDK9ESR1
SCHEMBL19633400 0.84 EHMT2 (0.36) MAP3K12ESR1
SCHEMBL19633517 0.82 EHMT2 (0.39) CCNT1ESR1
SCHEMBL19957822 0.81 ESR1 (0.33) CCNT1CDK9MAP3K12ESR1HRH3
SCHEMBL15833940 0.81 KCNN2 (0.38) CCNT1CDK9BRD4
SCHEMBL15834078 0.77 RXRA (0.32) CCNT1CDK9ESR1HRH3
SCHEMBL21064102 0.77 CCNT1 (0.38) CCNT1CDK9MAP3K12ESR1HRH3
SCHEMBL17300802 0.77 HRH4 (0.42) CCNT1CDK9BRD4
SCHEMBL20252427 0.77 CCNT1 (0.49) CCNT1CDK9

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-2935243-B1 PRMT5 INHIBITORS CONTAINING A DIHYDRO- OR TETRAHYDROISOQUINOLINE AND USES THEREOF EPIZYME INC (US) 2018-03-14 — — EP disclosed
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