SCHEMBL8517638

SCHEMBL8517638

CCCCCCCCC(O)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
PPARG P37231 4/20 0.48
GABRA1 P14867 1/20 0.45
GABRB2 P47870 1/20 0.45
CSNK1E P49674 1/20 0.45
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
PPARA Q07869 2/20 0.42
NAAA Q02083 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
HTR1A P08908 1/20 0.39

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
SCHEMBL4146572 1.00 TSHR (0.50) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL22444754 1.00 TSHR (0.50) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL22444751 1.00 TSHR (0.50) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL30714953 0.98 TSHR (0.52) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL6690451 0.98 TSHR (0.52) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL4981071 0.92 TSHR (0.53) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL4738271 0.86 TSHR (0.55) TSHRPPARGGABRA1GABRB2ALDH1A1
SCHEMBL22444478 0.86 TSHR (0.47) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL11809865 0.86 TSHR (0.47) TSHRPPARGGABRA1GABRB2CSNK1E
SCHEMBL9790245 0.86 MEN1 (0.44) TSHRPPARGCSNK1EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed
US-5958392-A HAIR CONNDITIONERS COMPRISING A BLEND OF AMPHOTERIC ADDITION POLYMERS CONTAINING AMINE AND CARBOXY OR SULFO GROUPS AND A QUAATERNIZED VINYLPYRROLIDONE/AMINOALCOHOL ACRYLATE COPOLYMER; SOFTNESS; SILKY FEEL L'OREAL (FR) 1999-09-28 US disclosed
US-4996059-A Shampoos, conditioners and cosmetics; softness, hold and texture L'OREAL (FR) 1991-02-26 US disclosed
US-4985042-A New substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1991-01-15 US disclosed
US-4954131-A Substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1990-09-04 US disclosed