SCHEMBL2942876

SCHEMBL2942876

O=C(O)C(c1ccccc1)c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
TDP1 Q9NUW8 2/20 0.50
SRC P12931 2/20 0.50
CYP2D6 P10635 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
IDO1 P14902 1/20 0.48
TDO2 P48775 1/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48

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
SCHEMBL180939 0.93 SRC (0.54) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL8853499 0.92 CNR1 (0.49) CNR1CNR2TDP1SRCCYP2D6
SCHEMBL27473645 0.91 SRC (0.52) CNR1CNR2TDP1SRCCYP2D6
SCHEMBL27577340 0.91 SRC (0.52) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL38022 0.88 SRC (0.62) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL8513250 0.88 SRC (0.62) CNR1CNR2TDP1SRCCYP2D6
SCHEMBL5132036 0.86 CNR1 (0.54) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL418537 0.85 SRC (0.59) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL9485695 0.85 SRC (0.59) CNR1CNR2TDP1SRCCYP2D6
Diphenylacetic Acid SCHEMBL8411440 0.85 SRC (0.59) CNR1CNR2TDP1SRCCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107580555-A Can laser labelling composition, product and file 爱克发-格法特公司 2018-01-12 CN disclosed
JP-2010105958-A POLYHYDROXYBENZENE DERIVATIVE AND SKIN PREPARATION FOR EXTERNAL USE TOYO BEAUTY KK 2010-05-13 JP disclosed
EP-0302516-B1 Optical article made of amorphous thermoplastic polyester resin MITSUBISHI RAYON CO (JP) 1993-12-15 EP disclosed
US-4910291-A From aromatic diacid MITSUBISHI RAYON COMPANY LTD. (JP) 1990-03-20 US disclosed
EP-0302516-A2 Optical article made of amorphous thermoplastic polyester resin MITSUBISHI RAYON CO., LTD. (JP) 1989-02-08 EP disclosed
US-4644377-A Fluoran derivatives and recording material using the same FUJI PHOTO FILM CO., LTD. (JP) 1987-02-17 US disclosed
US-4275221-A MICROBIOCIDES AND CHEMICAL INTERMEDIATES OF (CARBOALKOXY METHYL) PHENOXY-ACETOPHENONE RIKER LABORATORIES, INC. (US) 1981-06-23 US disclosed
US-4258213-A INTERMEDIATES FOR BACTERICIDES RIKER LABORATORIES, INC. (US) 1981-03-24 US disclosed
US-4247469-A INTERMEDIATES FOR THE 3-SUBSTITUTED-2-NITRO-PHENYL-BENZOFURANS, ANTIMICROBIAL RIKER LABORATORIES, INC. (US) 1981-01-27 US disclosed
US-4246179-A MICROBIOCIDES, ANTISEPTICS RIKER LABORATORIES, INC. (US) 1981-01-20 US disclosed
US-4208337-A INTERMEDIATES FOR MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1980-06-17 US disclosed
US-4172205-A Phenylalkanoic acid derivatives RIKER LABORATORIES, INC. (US) 1979-10-23 US disclosed
US-4153721-A MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1979-05-08 US disclosed
US-4143152-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1979-03-06 US disclosed