SCHEMBL23797166

SCHEMBL23797166

CCCCCC(N=C=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.40
TP53 P04637 1/20 0.37
FDPS P14324 4/20 0.35
LAP3 P28838 2/20 0.33
MAPT P10636 1/20 0.33
SMPD1 P17405 3/20 0.32
ZDHHC7 Q9NXF8 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
SPHK1 Q9NYA1 1/20 0.31
FFAR1 O14842 1/20 0.31
CA1 P00915 1/20 0.31

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
SCHEMBL22444837 0.98 OPRM1 (0.39) OPRM1TP53FDPSLAP3MAPT
SCHEMBL22444448 0.98 OPRM1 (0.39) OPRM1TP53FDPSLAP3MAPT
SCHEMBL22444467 0.98 OPRM1 (0.39) OPRM1TP53FDPSLAP3MAPT
SCHEMBL23797170 0.98 OPRM1 (0.39) OPRM1TP53FDPSLAP3MAPT
SCHEMBL22444484 0.94 FDPS (0.33) OPRM1TP53FDPS
SCHEMBL23797177 0.87 OPRM1 (0.34) OPRM1TP53FDPSLAP3MAPT
SCHEMBL23797143 0.87 OPRM1 (0.34) OPRM1TP53FDPSLAP3MAPT
SCHEMBL23797193 0.86 THRB (0.31)
SCHEMBL23797184 0.85 FDPS (0.36) OPRM1FDPSLAP3MAPTSMPD1
SCHEMBL23797186 0.85 FDPS (0.36) OPRM1FDPSLAP3MAPTSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574041-B Bisphenol production method and polycarbonate resin production method 三菱化学株式会社 2023-10-13 CN disclosed
EP-4118161-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES Covestro Deutschland AG (DE) 2023-01-18 EP disclosed
WO-2021180709-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES COVESTRO DEUTSCHLAND AG (DE) 2021-09-16 WO disclosed
EP-3878914-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES Covestro Deutschland AG (DE) 2021-09-15 EP disclosed