SCHEMBL7518905

SCHEMBL7518905

CCCCCCCC[C@@H]1C(=O)c2ccccc2O[C@@]1(O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPT P10636 1/20 0.36
GRM2 Q14416 3/20 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
SCHEMBL7513764 0.84 CYP3A4 (0.42) NPSR1CYP2C9CYP2C19MEN1RECQL
SCHEMBL3289417 0.76 CYP3A4 (0.42) NPSR1MEN1RECQLKMT2AL3MBTL1
SCHEMBL7517268 0.72 POLB (0.41) NPSR1CYP2C9CYP2C19MEN1RECQL
SCHEMBL7524782 0.72 POLB (0.41) NPSR1CYP2C9CYP2C19MEN1RECQL
SCHEMBL11387205 0.71 KMT2A (0.37) CYP2C9CYP2C19MEN1KMT2ACYP3A4
SCHEMBL11385622 0.71 MEN1 (0.37) MEN1KMT2A
SCHEMBL29130447 0.70 ALOX15 (0.41) NPSR1KMT2ACYP3A4ALOX15HSP90AA1
SCHEMBL4087910 0.70 MMP2 (0.38) MMP2MMP3MMP9GRM2
SCHEMBL29130441 0.70 CASP6 (0.45) NPSR1CYP2C9CYP2C19KMT2ACYP3A4
SCHEMBL11590452 0.68 PGR (0.46) TDP1GRM2

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