SCHEMBL7520676

SCHEMBL7520676

C[C@@H]1C(=O)c2ccccc2O[C@@]1(O)c1ccccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
RET P07949 1/20 0.36
KDR P35968 1/20 0.36
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
PDK2 Q15119 2/20 0.33
PGR P06401 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
AKR1B1 P15121 3/20 0.32
PTGS2 P35354 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.32
CYP19A1 P11511 1/20 0.32

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
SCHEMBL7520344 0.81 RET (0.45) RETKDRCYP3A4ALOX15ALDH1A1
SCHEMBL7527043 0.77 CHRNA1 (0.45) RETKDRCYP3A4ALOX15ALDH1A1
SCHEMBL3306471 0.76 CYP19A1 (0.43) CRHBPCRHR2CYP3A4ALOX15MAPT
SCHEMBL2337166 0.76 CYP19A1 (0.43) CRHBPCRHR2CYP3A4ALOX15MAPT
SCHEMBL7521676 0.76 MAPT (0.43) CYP3A4ALOX15ALDH1A1MAPTHPGD
SCHEMBL8484519 0.74 CYP19A1 (0.47) CYP3A4ALOX15ALDH1A1MAPTHPGD
SCHEMBL7516218 0.73 MEN1 (0.40) CYP3A4ALOX15ALDH1A1MAPTHSP90AA1
SCHEMBL7530287 0.72 OPRD1 (0.37) CYP3A4ALOX15PDK2PGRALDH1A1
SCHEMBL7520906 0.72 KDM4E (0.39) CYP3A4ALOX15MAPTMAOBMAOA
SCHEMBL7762100 0.71 IDO1 (0.38) CYP3A4ALOX15ALDH1A1MAPTHPGD

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