SCHEMBL9453752

SCHEMBL9453752

Cc1ccc(C(C)(C)c2ccccc2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.56
ESR2 Q92731 4/20 0.56
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 1/20 0.56
CNR1 P21554 4/20 0.49
CNR2 P34972 4/20 0.49
CYP19A1 P11511 1/20 0.49
KIF11 P52732 3/20 0.47
NR3C2 P08235 3/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AR P10275 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41
ESRRG P62508 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL9064553 0.88 ESR1 (0.61) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL10634189 0.85 ESR1 (0.50) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL20345298 0.84 ESR1 (0.52) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL9789252 0.84 ESR1 (0.52) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL7535051 0.83 ESR1 (0.75) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL11020737 0.81 ESR1 (0.50) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL2692670 0.81 ESR1 (0.80) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL3684822 0.80 ESR1 (0.67) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL35881 0.80 ESR1 (0.70) ESR1ESR2CYP3A4ALDH1A1CNR1
SCHEMBL14910456 0.80 ESR1 (0.70) ESR1ESR2CYP3A4ALDH1A1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5210353-A Transarylalkylation AMOCO CORPORATION (US) 1993-05-11 US claimed
US-20230183424-A1 POLYAMIDE-IMIDE-BASED FILM, PREPARATION METHOD THEREOF, AND COVER WINDOW AND DISPLAY DEVICE COMPRISING THE SAME MICROWORKS SOLUTIONS CO., LTD. (KR) 2023-06-15 US disclosed
US-20150004484-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-01-01 US disclosed
US-20140370375-A1 ORGANIC ELECTROLYTE AND ORGANIC ELECTROLYTE STORAGE BATTERY JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-12-18 US disclosed
EP-2797154-A1 ORGANIC ELECTROLYTE, AND ORGANIC ELECTROLYTE STORAGE BATTERY JX Nippon Oil & Energy Corporation (JP) 2014-10-29 EP disclosed
EP-2797153-A1 ORGANIC ELECTROLYTE, AND ORGANIC ELECTROLYTE STORAGE BATTERY JX Nippon Oil & Energy Corporation (JP) 2014-10-29 EP disclosed
US-5210353-A Transarylalkylation AMOCO CORPORATION (US) 1993-05-11 US disclosed