SCHEMBL8935705

SCHEMBL8935705

CC[C@H](Oc1cccc(C)c1C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
PPARA Q07869 11/20 0.48
PPARG P37231 10/20 0.44
PTGES O14684 4/20 0.43
ALOX5 P09917 4/20 0.43
POLB P06746 2/20 0.41
LTB4R Q15722 1/20 0.41
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
PPARD Q03181 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL8935703 1.00 SMN1; SMN2 (0.54) SMN1; SMN2PPARAPPARGPTGESALOX5
SCHEMBL11360035 0.88 PPARG (0.51) SMN1; SMN2PPARAPPARGPTGESALOX5
SCHEMBL3879629 0.87 SMN1; SMN2 (0.57) SMN1; SMN2PPARAPPARGTDP1
SCHEMBL8935641 0.87 SMN1; SMN2 (0.57) SMN1; SMN2PPARAPPARGTDP1
SCHEMBL4904732 0.86 MAPT (0.42) SMN1; SMN2PPARAPPARGPTGESALOX5
SCHEMBL11366338 0.84 LMNA (0.45) SMN1; SMN2POLBMAPTLMNARAB9A
SCHEMBL31698014 0.84 SMN1; SMN2 (0.48) SMN1; SMN2PPARAPPARGPOLBLTB4R
SCHEMBL28829280 0.84 SMN1; SMN2 (0.48) SMN1; SMN2PPARAPPARGPOLBLTB4R
SCHEMBL28490552 0.84 PPARG (0.49) SMN1; SMN2PPARAPPARGPTGESALOX5
SCHEMBL8935678 0.81 SMN1; SMN2 (0.58) SMN1; SMN2PPARAPPARGL3MBTL1KMT2A

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