SCHEMBL1008969

SCHEMBL1008969

CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](CO)COCCCCCCCCCCCCCCCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.78
FAAH O00519 1/20 0.78
MAPT P10636 1/20 0.78
HPGD P15428 1/20 0.78
CNR1 P21554 1/20 0.78
CNR2 P34972 1/20 0.78
S1PR1 P21453 1/20 0.69
PRKCA P17252 2/20 0.69
PRKCE Q02156 1/20 0.69
PRKCQ Q04759 1/20 0.69
PRKCD Q05655 1/20 0.69
GPR55 Q9Y2T6 2/20 0.60

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
SCHEMBL11895706 1.00 ALDH1A1 (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL1008217 1.00 ALDH1A1 (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL3710596 1.00 ALDH1A1 (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL10492005 0.97 ALDH1A1 (0.74) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL10492058 0.94 ALDH1A1 (0.69) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL2520687 0.94 PRKCA (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL9754681 0.94 PRKCA (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL10491979 0.94 PRKCA (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL22558535 0.94 PRKCA (0.78) ALDH1A1FAAHMAPTHPGDCNR1
SCHEMBL9754687 0.94 PRKCA (0.78) ALDH1A1FAAHMAPTHPGDCNR1

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-2268272-A2 COMPOUNDS THAT MODULATE NEGATIVE-SENSE, SINGLE-STRANDED RNA VIRUS REPLICATION AND USES THEREOF Mount Sinai School of Medicine of New York University (US) 2011-01-05 EP disclosed
WO-2009136979-A2 COMPOUNDS THAT MODULATE NEGATIVE-SENSE, SINGLE-STRANDED RNA VIRUS REPLICATION AND USES THEREOF MOUNT SINAI SCHOOL OF MEDICINE OF NEW YORK UNIVERSITY (US) 2009-11-12 WO disclosed
WO-2001068137-A2 COMPOSITIONS FOR REGULATING MEMORY CONSOLIDATION BROWN UNIVERSITY RESEARCH FOUNDATION (US) 2001-09-20 WO disclosed