SCHEMBL7520904

SCHEMBL7520904

Cc1ccc2c(c1)C(=O)[C@H](C)[C@](O)(c1ccccc1)O2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.45
KDM4E B2RXH2 4/20 0.41
ATM Q13315 3/20 0.41
RAD52 P43351 1/20 0.41
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
HTT P42858 1/20 0.37
CHRNB2 P17787 2/20 0.37
SLC6A2 P23975 2/20 0.37
CHRNB4 P30926 2/20 0.37
CHRNA3 P32297 2/20 0.37
CHRNA4 P43681 2/20 0.37
SLC6A3 Q01959 2/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL7526818 1.00 CYP19A1 (0.45) CYP19A1KDM4EATMRAD52CRHBP
SCHEMBL7521049 0.89 CYP19A1 (0.46) CYP19A1KDM4EATMRAD52CRHBP
SCHEMBL7522670 0.85 CYP19A1 (0.44) CYP19A1CRHBPCRHR2HTTCHRNB2
SCHEMBL2337166 0.83 CYP19A1 (0.43) CYP19A1CRHBPCRHR2CHRNB2SLC6A2
SCHEMBL3306471 0.83 CYP19A1 (0.43) CYP19A1CRHBPCRHR2CHRNB2SLC6A2
SCHEMBL7519608 0.81 CYP19A1 (0.39) CYP19A1KDM4EATMRAD52CHRNB2
SCHEMBL7520858 0.78 KDM4E (0.43) CYP19A1KDM4ECRHBPCRHR2HTT
SCHEMBL7519643 0.77 MAP3K14 (0.39) CYP19A1CRHBPCRHR2CHRNB2SLC6A2
SCHEMBL7523465 0.77 MAP3K14 (0.39) CYP19A1CRHBPCRHR2CHRNB2SLC6A2
SCHEMBL7521156 0.76 CYP19A1 (0.50) CYP19A1KDM4EATMCRHBPCRHR2

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