SCHEMBL6433402

SCHEMBL6433402

CC(=O)OCCCC/C=C/CCCl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
FAAH O00519 2/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38
EPHX2 P34913 2/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
HTR1A P08908 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRNB2 P17787 1/20 0.36

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
SCHEMBL6433405 1.00 ALDH1A1 (0.47) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29572495 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29566405 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29566283 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL24301308 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL24301312 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29566217 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29566265 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL29566292 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL30631728 0.98 ALDH1A1 (0.45) ALDH1A1FAAHCNR1CNR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1230207-B1 METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS PEDERSON RICHARD L (US) 2005-06-22 EP claimed
US-6696597-B2 CROSS-METATHESIZING A TERMINAL OLEFIN AND INTERNAL OLEFIN IN PRESENCE OF CATALYST, TO FORM METATHESIS PRODUCT AND A SIDE PRODUCT; APPLYING CONDITIONS OF SUFFICIENTLY HIGH TEMPERATURE AND/OR LOW PRESSURE TO EVAPORTE SIDE PRODUCT TILLIECHEM, INC. 2004-02-24 US claimed
EP-1230207-A2 METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS Pederson, Richard L. (US) 2002-08-14 EP claimed
US-20020022741-A1 Metathesis syntheses of pheromones or their components MATERIA, INC. 2002-02-21 US claimed
WO-2001036368-A2 METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS PEDERSON RICHARD L (US) 2001-05-25 WO claimed
EP-1230207-B1 METATHESIS SYNTHESES OF PHEROMONES OR THEIR COMPONENTS PEDERSON RICHARD L (US) 2005-06-22 EP disclosed
US-6696597-B2 CROSS-METATHESIZING A TERMINAL OLEFIN AND INTERNAL OLEFIN IN PRESENCE OF CATALYST, TO FORM METATHESIS PRODUCT AND A SIDE PRODUCT; APPLYING CONDITIONS OF SUFFICIENTLY HIGH TEMPERATURE AND/OR LOW PRESSURE TO EVAPORTE SIDE PRODUCT TILLIECHEM, INC. 2004-02-24 US disclosed
US-20020022741-A1 Metathesis syntheses of pheromones or their components MATERIA, INC. 2002-02-21 US disclosed