SCHEMBL26560280

SCHEMBL26560280

Cn1c(=O)nc(N2CCC(Oc3ccc(OC(F)(F)F)cc3)CC2)c2nc(Cl)ccc21

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DGKZ Q13574 13/20 0.45
▸ DGKA P23743 11/20 0.45
▸ SCD O00767 5/20 0.43
▸ FPR2 P25090 2/20 0.41
▸ PROKR1 Q8TCW9 2/20 0.41

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
SCHEMBL26558325 0.87 DGKZ (0.57) DGKZDGKA
SCHEMBL26560805 0.86 DGKA (0.41) DGKZDGKAFPR2PROKR1
SCHEMBL23600164 0.83 SCD (0.47) DGKZDGKASCD
SCHEMBL31133732 0.80 DGKA (0.43) DGKZDGKASCDFPR2PROKR1
SCHEMBL23527128 0.80 DGKA (0.43) DGKZDGKASCDFPR2PROKR1
SCHEMBL23600334 0.77 CHRM4 (0.40) DGKZDGKASCD
SCHEMBL26558525 0.76 DGKZ (0.40) DGKZDGKA
SCHEMBL23527118 0.74 DGKZ (0.50) DGKZDGKA
SCHEMBL31133744 0.74 DGKZ (0.50) DGKZDGKA
SCHEMBL26558526 0.73 DGKZ (0.39) DGKZDGKA

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
WO-2023184327-A1 KINASE INHIBITORS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-10-05 — — WO disclosed
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