SCHEMBL27131603

SCHEMBL27131603

Cc1cc(Nc2ncc3c(n2)N2CCN=C2N(c2c(Cl)cccc2Cl)C3=O)ccc1N1CC(C)N(C(C)C)[C@@H](C)C1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 17/20 0.61
▸ EGFR P00533 2/20 0.42
▸ CSF1R P07333 2/20 0.42
▸ KCNH2 Q12809 1/20 0.42

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
SCHEMBL29506494 1.00 WEE1 (0.61) WEE1EGFRCSF1RKCNH2
SCHEMBL21373356 1.00 WEE1 (0.61) WEE1EGFRCSF1RKCNH2
SCHEMBL21373417 0.95 WEE1 (0.61) WEE1EGFRCSF1RKCNH2
SCHEMBL29506535 0.95 WEE1 (0.61) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL23246139 0.94 WEE1 (0.63) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL21373352 0.94 WEE1 (0.63) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL29859319 0.94 WEE1 (0.63) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL29506543 0.94 WEE1 (0.63) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL27123597 0.94 WEE1 (0.63) WEE1EGFRCSF1RKCNH2
Potrasertib SCHEMBL23246122 0.92 WEE1 (0.61) WEE1EGFRCSF1RKCNH2

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-3543242-B1 8,9-DIHYDROIMIDAZOLE[1,2-A]PYRIMIDO[5,4-E]PYRIMIDINE-5(6H)-KETONE COMPOUND IMPACT THERAPEUTICS SHANGHAI INC (CN) 2024-01-03 — — EP claimed
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