SCHEMBL28413729

SCHEMBL28413729

O=COCCc1cnc(Cl)nc1Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PIN1 Q13526 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CASP6 P55212 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
SCHEMBL28409735 0.83 POLB (0.32) PIN1POLBCASP6
SCHEMBL30961423 0.77 KDM4E (0.36) PIN1
SCHEMBL30961284 0.75 MYC (0.39) —
SCHEMBL27145902 0.74 LMNA (0.35) —
SCHEMBL28809315 0.73 — —
SCHEMBL1442195 0.73 TYRO3 (0.32) POLBCASP6
SCHEMBL6203110 0.72 KDM4E (0.31) —
SCHEMBL6219173 0.71 AURKA (0.34) —
SCHEMBL6203090 0.71 KDM4E (0.31) —
SCHEMBL6204668 0.71 PDXK (0.37) —

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
CN-111303125-A Methoxy-substituted indole-pyrimidine compound and preparation method thereof 天津法莫西医药科技有限公司 2020-06-19 — — CN disclosed
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