SCHEMBL23802424

SCHEMBL23802424

CCCCCCC(=O)c1ccc2c(c1)c1cc(C(=O)c3ccc(OCO)cc3)ccc1n2CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.48
HRH2 P25021 4/20 0.44
HRH1 P35367 4/20 0.44
PLA2G2A P14555 2/20 0.44
PLA2G4A P47712 2/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 0.42
TUBB2B Q9BVA1 1/20 0.42
TUBB1 Q9H4B7 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
SCHEMBL23801811 0.99 CNR2 (0.49) CNR2HRH2HRH1PLA2G2APLA2G4A
SCHEMBL25515494 0.87 CNR2 (0.48) CNR2PLA2G2ATUBB4ATUBBTUBA3C
SCHEMBL25515534 0.86 CNR2 (0.49) CNR2HRH2HRH1TUBB4ATUBB
SCHEMBL23801337 0.85 HSD17B3 (0.58) CNR2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3184975 0.85 CNR2 (0.65) CNR2PLA2G2ATUBB4ATUBBTUBA3C
SCHEMBL23801787 0.85 HSD17B3 (0.58) CNR2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL23801348 0.85 HSD17B3 (0.58) CNR2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL22534570 0.85 HSD17B3 (0.54) CNR2
SCHEMBL23802405 0.85 CNR2 (0.46) CNR2HRH2HRH1PLA2G2APLA2G4A
SCHEMBL23802413 0.85 CNR2 (0.46) CNR2HRH2HRH1PLA2G2APLA2G4A

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