SCHEMBL7522409

SCHEMBL7522409

Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.56
CYP19A1 P11511 5/20 0.54
MAOB P27338 2/20 0.54
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
RET P07949 1/20 0.50
KDR P35968 1/20 0.50
TNKS2 Q9H2K2 1/20 0.40
ESR2 Q92731 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL5579748 1.00 ESR1 (0.56) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL11043870 0.88 ESR1 (0.56) ESR1CYP19A1MAOBRETKDR
SCHEMBL5579742 0.88 ESR1 (0.56) ESR1CYP19A1MAOBRETKDR
SCHEMBL11251156 0.78 CYP19A1 (0.48) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL8702376 0.75 ESR1 (0.45) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL9434848 0.75 ESR1 (0.45) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL92288 0.75 ESR1 (0.45) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL11383340 0.74 CYP19A1 (0.44) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL31015940 0.73 RET (0.41) ESR1CYP19A1MAOBMEN1KMT2A
SCHEMBL29209401 0.71 CYP19A1 (0.41) ESR1CYP19A1MAOBMEN1KMT2A

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 5 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
JP-2000198779-A PURIFICATION OF 3-ALKYLFLAVANOL DERIVATIVE KAO CORP 2000-07-18 JP 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