SCHEMBL4553576

SCHEMBL4553576

COC(=O)[C](C)C(=O)OC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.47
NAAA Q02083 2/20 0.40
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
CYP2C19 P33261 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
GPR35 Q9HC97 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
CYP19A1 P11511 2/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 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
SCHEMBL1584701 0.85 EPHX1 (0.52) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL27595620 0.83 EPHX1 (0.48) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL2059955 0.81 ALDH1A1 (0.56) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL974950 0.81 ALDH1A1 (0.56) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL28271240 0.81 EPHX1 (0.44) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL4672536 0.81 EPHX1 (0.50) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL7814661 0.79 EPHX1 (0.47) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL755855 0.79 EPHX1 (0.48) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL28168096 0.79 EPHX1 (0.44) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL4676851 0.78 EPHX1 (0.47) EPHX1NAAAHTTSMN1; SMN2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114437-A2 MODIFIED CORTICOTROPIN RELEASING FACTOR PEPTIDES AND USES THEREOF ConjuChem Biotechnologies Inc. (CA) 2009-11-11 EP disclosed
WO-2008047241-A2 MODIFIED CORTICOTROPIN RELEASING FACTOR PEPTIDES AND USES THEREOF CONJUCHEM BIOTECHNOLOGIES INC. (US) 2008-04-24 WO disclosed