SCHEMBL7520858

SCHEMBL7520858

C[C@@H]1C(=O)c2ccc(O)cc2O[C@@]1(O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ESR1 P03372 6/20 0.41
ESR2 Q92731 4/20 0.41
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
CYP19A1 P11511 1/20 0.40
PSMB5 P28074 1/20 0.40
MIF P14174 1/20 0.38
MAPT P10636 2/20 0.37
SIRT1 Q96EB6 1/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
SMAD3 P84022 1/20 0.37
KMT2A Q03164 1/20 0.37
PRMT1 Q99873 1/20 0.37

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
SCHEMBL7521746 0.88 ALDH1A1 (0.42) KDM4EALDH1A1ESR1ESR2MAOA
SCHEMBL7521049 0.86 CYP19A1 (0.46) KDM4EALDH1A1MAOAMAOBCYP19A1
SCHEMBL7519643 0.85 MAP3K14 (0.39) CYP19A1MAPTCRHBPCRHR2
SCHEMBL7523465 0.85 MAP3K14 (0.39) CYP19A1MAPTCRHBPCRHR2
SCHEMBL7521156 0.84 CYP19A1 (0.50) KDM4EALDH1A1MAOBCYP19A1MAPT
SCHEMBL7521676 0.83 MAPT (0.43) KDM4EALDH1A1ESR1ESR2MAPT
SCHEMBL7519457 0.78 TP53 (0.40) KDM4EALDH1A1MAOAMAOBCYP19A1
SCHEMBL7526818 0.78 CYP19A1 (0.45) KDM4EMAOBCYP19A1HTTCRHBP
SCHEMBL7520904 0.78 CYP19A1 (0.45) KDM4EMAOBCYP19A1HTTCRHBP
SCHEMBL7522670 0.77 CYP19A1 (0.44) MAOBCYP19A1MAPTMEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743311-B1 FLAVANONOL DERIVATIVES AND HAIR NOURISHMENT AND GROWTH STIMULANT COMPOSITION CONTAINING THE SAME KAO CORP (JP) 2002-02-13 EP disclosed
US-5876703-A CELL DIFFERENTIATION OF HAIR MATRIX CELLS KAO CORPORATION (JP) 1999-03-02 US disclosed
US-5702691-A Flavanonol derivatives and hair-nourishing, hair growing compositions containing the derivatives KAO CORPORATION (JP) 1997-12-30 US disclosed
EP-0743311-A1 FLAVANONOL DERIVATIVES AND HAIR NOURISHMENT AND GROWTH STIMULANT COMPOSITION CONTAINING THE SAME Kao Corporation (JP) 1996-11-20 EP disclosed