SCHEMBL7902214

SCHEMBL7902214

O=C(OOc1ccccc1)[C@H](Cc1ccccc1)N(O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.41
PPARA Q07869 6/20 0.41
CYP1A2 P05177 1/20 0.41
CHRM1 P11229 1/20 0.40
SRR Q9GZT4 2/20 0.39
EPHX1 P07099 1/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
NPY5R Q15761 1/20 0.39
ALPI P09923 1/20 0.39
PKM P14618 1/20 0.39
PTGS1 P23219 1/20 0.39
XIAP P98170 1/20 0.39
SLC7A5 Q01650 1/20 0.39
CTRB1 P17538 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL27420280 0.84 PPARG (0.43) PPARGPPARACYP1A2SRRSLC1A3
SCHEMBL28878522 0.79 ATM (0.50) CTRB1ALDH1A1MAPT
SCHEMBL27987428 0.79 CYP1A2 (0.44) CYP1A2CHRM1SRREPHX1SLC1A3
SCHEMBL29112710 0.79 CYP1A2 (0.44) PPARGPPARACYP1A2CHRM1SRR
SCHEMBL5151597 0.79 ATM (0.50) CTRB1ALDH1A1MAPT
SCHEMBL28283100 0.79 SRR (0.50) CYP1A2CHRM1SRREPHX1SLC1A3
SCHEMBL7450953 0.78 CRHBP (0.44) PPARGPPARACYP1A2CHRM1SRR
SCHEMBL28239477 0.78 CYP1A2 (0.43) PPARGPPARACYP1A2CHRM1SRR
SCHEMBL29127421 0.78 CYP1A2 (0.43) PPARGPPARACYP1A2CHRM1SRR
Hydrochloric Acid SCHEMBL28015581 0.78 ATM (0.49) CTRB1ALDH1A1MAPT

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-6187325-B1 Use of at least one extract of a rosacea of the genus Sanguisorba officinalis for promoting pigmentation of the skin and/or the body hair and/or the cranial hair L'OREAL (FR) 2001-02-13 US disclosed