SCHEMBL25449059

SCHEMBL25449059

Cc1ccc(Nc2nc(Cl)ncc2Cl)c(P(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK3 P27361 8/20 0.41
▸ LCK P06239 1/20 0.38
▸ CCNA2 P20248 4/20 0.36
▸ CDK2 P24941 4/20 0.36
▸ CCNK O75909 3/20 0.36
▸ CDK9 P50750 3/20 0.36
▸ CCND3 P30281 2/20 0.36
▸ CDK6 Q00534 2/20 0.36
▸ EGFR P00533 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ BCL6 P41182 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ ALK Q9UM73 1/20 0.34

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
SCHEMBL25449111 0.89 EGFR (0.36) MAPK3LCKEGFRNPC1
SCHEMBL24179107 0.87 MEN1 (0.43) MAPK3LCKEGFRNPC1ALK
SCHEMBL23153915 0.85 LRRK2 (0.35) MAPK3CCNA2CDK2CCNKCDK9
SCHEMBL24179306 0.84 MAPK3 (0.44) MAPK3
SCHEMBL15600758 0.82 CCNA2 (0.43) MAPK3CCNA2CDK2CCNKCDK9
SCHEMBL30833778 0.82 CCNA2 (0.43) MAPK3CCNA2CDK2CCNKCDK9
SCHEMBL29761996 0.82 CCNA2 (0.43) MAPK3CCNA2CDK2CCNKCDK9
SCHEMBL10042752 0.81 MAPK3 (0.40) MAPK3LCKCCNA2CDK2CCNK
SCHEMBL10042753 0.81 MAPK3 (0.44) MAPK3LCKCCNA2CDK2CCNK
SCHEMBL23154046 0.77 MEN1 (0.38) ALK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4393930-A1 CRYSTAL FORMS, PREPARATION METHOD AND APPLICATION OF ARYL PHOSPHINE OXIDE COMPOUND Chengdu Di'Ao Jiuhong Pharmaceutical Factory (CN) 2024-07-03 — — EP disclosed
EP-4177258-A1 ARYLPHOSPHINE OXIDE COMPOUNDS AND USE THEREOF Chengdu Di'Ao Jiuhong Pharmaceutical Factory (CN) 2023-05-10 — — EP disclosed
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