SCHEMBL23802445

SCHEMBL23802445

CCCCCC/C(=N\OC(C)=O)C(=O)c1ccc2c(c1)c1cc(C(=O)c3ccc(C)cc3)ccc1n2CCCOC

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.46
NPC1 O15118 2/20 0.37
CNR1 P21554 2/20 0.36
PTGER4 P35408 2/20 0.36
PLA2G2A P14555 1/20 0.35

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
SCHEMBL25515781 0.82 CNR2 (0.49) CNR2NPC1CNR1
SCHEMBL13541267 0.82 CNR2 (0.53) CNR2NPC1CNR1
SCHEMBL13925254 0.82 CNR2 (0.53) CNR2NPC1CNR1
SCHEMBL21431251 0.81 KDM4E (0.45) CNR2NPC1CNR1
SCHEMBL25522253 0.78 CNR2 (0.45) CNR2NPC1CNR1PTGER4
SCHEMBL267676 0.78 CNR2 (0.42) CNR2NPC1CNR1
SCHEMBL31346590 0.78 CNR2 (0.40) CNR2NPC1CNR1PLA2G2A
SCHEMBL31346589 0.78 CNR2 (0.40) CNR2NPC1CNR1
SCHEMBL11960281 0.78 CNR2 (0.41) CNR2NPC1CNR1PLA2G2A
SCHEMBL17070006 0.78 CNR2 (0.41) CNR2NPC1CNR1PLA2G2A

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-2021175855-A1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2021-09-10 WO disclosed