SCHEMBL23797199

SCHEMBL23797199

CCCCCCCC(N=C=O)OC(CCCCCCC)N=C=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
LAP3 P28838 2/20 0.37
OPRM1 P35372 1/20 0.37
SMPD1 P17405 3/20 0.36
GPR84 Q9NQS5 3/20 0.35
FDPS P14324 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
FFAR1 O14842 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL23797203 1.00 MAPT (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL23797157 1.00 MAPT (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL23797154 0.98 OPRM1 (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL16949968 0.92 CA2 (0.31) OPRM1FDPS
SCHEMBL22444563 0.86 ZDHHC7 (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL22444549 0.86 ZDHHC7 (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL23797164 0.86 ZDHHC7 (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL23797146 0.86 ZDHHC7 (0.38) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL23797170 0.85 OPRM1 (0.39) MAPTLAP3OPRM1SMPD1GPR84
SCHEMBL22444837 0.85 OPRM1 (0.39) MAPTLAP3OPRM1SMPD1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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