SCHEMBL29234124

SCHEMBL29234124

OB(O)c1c(O)ccc(C2CC2)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 4/20 0.32
▸ ALOX5AP P20292 3/20 0.32
▸ NOTUM Q6P988 1/20 0.31
▸ WDR5 P61964 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
SCHEMBL20090384 0.80 KDM1A (0.36) NOTUM
SCHEMBL12223404 0.78 FEN1 (0.36) FEN1ALOX5APNOTUMWDR5
SCHEMBL24203140 0.73 FEN1 (0.33) FEN1ALOX5APNOTUMWDR5
SCHEMBL25981340 0.72 NOTUM (0.40) FEN1ALOX5APNOTUM
SCHEMBL11939197 0.72 FEN1 (0.39) FEN1ALOX5APNOTUMWDR5
SCHEMBL18128452 0.71 CA3 (0.36) —
SCHEMBL3795063 0.71 PDK2 (0.37) NOTUM
SCHEMBL30154900 0.71 CA3 (0.36) —
SCHEMBL28204231 0.71 NUDT1 (0.41) FEN1ALOX5AP
SCHEMBL31013573 0.71 ALOX5AP (0.31) FEN1ALOX5AP

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-118184669-A Macrocyclic compounds as multi-target kinase inhibitors 北京伯汇生物技术有限公司 2024-06-14 — — CN disclosed
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