SCHEMBL8935912

SCHEMBL8935912

CCC(Oc1c(Br)cccc1Br)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
PTPN1 P18031 3/20 0.46
PPARA Q07869 11/20 0.46
PPARG P37231 9/20 0.46
PLAU P00749 2/20 0.36
FABP4 P15090 1/20 0.36
PLG P00747 1/20 0.36
PLAT P00750 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
SCHEMBL8935919 1.00 SMN1; SMN2 (0.49) SMN1; SMN2PTPN1PPARAPPARGPLAU
SCHEMBL17673228 0.84 KMT2A (0.40) SMN1; SMN2PTPN1PPARAPPARG
SCHEMBL8935797 0.81 PPARA (0.49) SMN1; SMN2PTPN1PPARAPPARG
SCHEMBL1245341 0.81 PPARA (0.49) SMN1; SMN2PTPN1PPARAPPARG
SCHEMBL8935678 0.81 SMN1; SMN2 (0.58) SMN1; SMN2PPARAPPARG
SCHEMBL8935675 0.81 SMN1; SMN2 (0.58) SMN1; SMN2PPARAPPARG
Hydrochloric Acid SCHEMBL8074407 0.80 PPARA (0.48) SMN1; SMN2PTPN1PPARAPPARG
SCHEMBL8935787 0.79 SMN1; SMN2 (0.49) SMN1; SMN2PPARAPPARG
SCHEMBL8935688 0.79 SMN1; SMN2 (0.49) SMN1; SMN2PPARAPPARG
SCHEMBL8935685 0.79 SMN1; SMN2 (0.49) SMN1; SMN2PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed