SCHEMBL27889673

SCHEMBL27889673

CC(C)(C)c1cccc(C(C)(C)C)c1OCC(CO)(CO)CO

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.42
ALDH1A1 P00352 8/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 2/20 0.35
NAMPT P43490 1/20 0.34
NR1H4 Q96RI1 1/20 0.33
NLRP3 Q96P20 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
SCN2A Q99250 1/20 0.32

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
SCHEMBL28979480 0.90 ALDH1A1 (0.50) CA2ALDH1A1GABRA1GABRB2TSHR
Pyrophosphoric Acid SCHEMBL13506565 0.88 NAMPT (0.34) CA2ALDH1A1GABRA1GABRB2KDM4E
SCHEMBL27995844 0.82 ALDH1A1 (0.37) ALDH1A1TDP1KDM4ESMN1; SMN2
SCHEMBL5968095 0.80 CA2 (0.48) CA2ALDH1A1GABRA1GABRB2TSHR
SCHEMBL16195513 0.80 ALDH1A1 (0.50) ALDH1A1TDP1KDM4ESMN1; SMN2GAA
SCHEMBL5347930 0.80 RXRA (0.38) ALDH1A1GABRA1GABRB2TSHRRXRA
SCHEMBL2232697 0.80 SMN1; SMN2 (0.44) CA2ALDH1A1TSHRSMN1; SMN2
SCHEMBL6552135 0.80 ALDH1A1 (0.38) CA2ALDH1A1GABRA1GABRB2TSHR
SCHEMBL13506563 0.79 BTN3A1 (0.33) ALDH1A1GAANAMPTNR1H4
SCHEMBL8962428 0.78 ALOX15 (0.34) ALDH1A1

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-105511226-A Photosensitive resin composition DONGWOO FINE CHEM CO LTD 2016-04-20 CN claimed
CN-107922718-A Polybutylene terephthalate (PBT) resin combination 胜技高分子株式会社 2018-04-17 CN disclosed
CN-104703790-B Article and layered product 住友电木株式会社 2018-01-02 CN disclosed
CN-107003450-A Stack membrane 柯尼卡美能达株式会社 2017-08-01 CN disclosed
CN-105985768-A Coated semiconductor nanoparticle and method for manufacturing the same 柯尼卡美能达株式会社 2016-10-05 CN disclosed
CN-105511226-A Photosensitive resin composition DONGWOO FINE CHEM CO LTD 2016-04-20 CN disclosed
CN-103717392-B Panel and panel arrangement structure MITSUBISHI ENGINEERING-PLASTICS CORP. (JP) 2016-02-03 CN disclosed
CN-103013104-B Halogen-free filling flame-retardant nylon 6 composite material and preparation method thereof SHANGHAI KINGFA SCI & TECH CO 2015-06-24 CN disclosed
CN-102414838-B Sheet for solar cell, and solar cell module MITSUBISHI PLASTICS INC 2015-05-06 CN disclosed
CN-104470984-A Cellulose ester-based resin composition ADEKA CORP 2015-03-25 CN disclosed
CN-102850730-B Laser-transmitting resin molded article, and composite molded article comprising the same WIN TECH POLYMER LTD. (JP) 2014-10-15 CN disclosed
CN-102026795-B Bendable polycarbonate resin laminate, optically transparent electromagnetic wave shield laminate, and manufacturing method thereof MITSUBISHI GAS CHEMICAL CO 2013-08-07 CN disclosed
CN-103013104-A Halogen-free filling flame-retardant nylon 6 composite material and preparation method thereof SHANGHAI KINGFA SCI & TECH CO 2013-04-03 CN disclosed
CN-102911487-A Glass fiber reinforced polybutylece terephthalate (PBT)/acrylonitrile styrene acrylate (ASA) alloy material and preparation method thereof SHANGHAI KINGFA SCI & TECH CO 2013-02-06 CN disclosed