SCHEMBL26224018

SCHEMBL26224018

CNc1nc(NC)c2ncn(CCCCOC(=O)NC(C)c3ccc(Cl)cc3)c2n1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 3/20 0.42
▸ YTHDC1 Q96MU7 11/20 0.41
▸ PDGFRA P16234 3/20 0.39
▸ CCNE1 P24864 3/20 0.39
▸ CDK2 P24941 3/20 0.39

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
SCHEMBL19575466 0.82 CDK1 (0.40) CCNE1CDK2
SCHEMBL26212075 0.82 CDK1 (0.40) CCNE1CDK2
SCHEMBL19575471 0.80 NSD3 (0.53) —
SCHEMBL26217256 0.80 NR3C1 (0.38) —
SCHEMBL19575394 0.80 NSD3 (0.53) —
SCHEMBL20974516 0.80 NSD3 (0.53) —
SCHEMBL26224120 0.75 TMIGD3 (0.44) YTHDC1
SCHEMBL19575401 0.74 YTHDC1 (0.37) YTHDC1
SCHEMBL26217517 0.73 YTHDC1 (0.56) P2RY1YTHDC1
SCHEMBL19575591 0.72 CTSL (0.47) YTHDC1CDK2

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-3452477-B1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B C I PHARMA (BE) 2023-09-13 — — EP disclosed
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