SCHEMBL9936598

SCHEMBL9936598

O=C1CC(Cc2ccc(O)cc2O)C(=O)N1C(CO)Cc1ccccc1.O=C1CC(Cc2ccc(O)cc2O)C(=O)N1CCc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 2/20 0.44
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL9969473 0.90 KMT2A (0.41) ALDH1A1KMT2AMEN1GAAPKM
SCHEMBL9969475 0.84 ALDH1A1 (0.49) ALDH1A1TSHRMAPK1KMT2AGAA
SCHEMBL16530041 0.82 MEN1 (0.36) ALDH1A1TSHRKMT2AMEN1GAA
SCHEMBL9936607 0.80 MME (0.39)
SCHEMBL16530080 0.77 ALDH1A1 (0.50) ALDH1A1TSHRKMT2AGAAPKM
SCHEMBL9968846 0.76 POLB (0.47) ALDH1A1TSHRKMT2AMEN1GAA
SCHEMBL9936487 0.76 ALDH1A1 (0.49) ALDH1A1TSHRKMT2AMEN1GAA
SCHEMBL9968851 0.76 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1KMT2AMEN1
SCHEMBL9936577 0.75 ALDH1A1 (0.46) ALDH1A1GAAPKMMAPT
SCHEMBL9937438 0.75 ALDH1A1 (0.39) ALDH1A1TSHRMAPK1KMT2AMEN1

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-2651886-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'Oréal (FR) 2013-10-23 EP claimed
WO-2012079938-A1 METHOD FOR DEPIGMENTING KERATIN MATERIALS USING RESORCINOL DERIVATIVES L'OREAL (FR) 2012-06-21 WO claimed