SCHEMBL11700289

SCHEMBL11700289

CCOc1nc(NC)nc(NC)c1N

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 3/20 0.32
▸ CDK2 P24941 3/20 0.32
▸ CCNA1 P78396 3/20 0.32
▸ MAPK8 P45983 1/20 0.31
▸ MAPK9 P45984 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL16465508 0.84 SMN1; SMN2 (0.37) CCNA2CDK2CCNA1MAPK8MAPK9
SCHEMBL11698190 0.83 CDK1 (0.38) CCNA2CDK2CCNA1MAPK8MAPK9
SCHEMBL10485343 0.76 TRIM58 (0.36) CYP1A2KMT2A
SCHEMBL16463307 0.71 SMN1; SMN2 (0.33) —
SCHEMBL16485072 0.70 CDK1 (0.45) CCNA2CDK2CCNA1MAPK8CYP1A2
SCHEMBL16465050 0.70 TLR7 (0.36) CCNA2CDK2CCNA1
SCHEMBL9643033 0.70 KMT2A (0.37) MEN1KMT2A
SCHEMBL16482078 0.69 TLR7 (0.35) CCNA2CDK2CCNA1
SCHEMBL16463543 0.69 SMN1; SMN2 (0.32) —
SCHEMBL16482192 0.68 CDK1 (0.37) CCNA2CDK2CCNA1KMT2A

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
US-4046503-A DEVELOPER-COUPLER HAIR DYES BASED ON ALKOXY-TRIAMINO-PYRIMIDINES HENKEL & CIE GMBH (DT) 1977-09-06 — — US disclosed
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