SCHEMBL3859151

SCHEMBL3859151

CC(C)(C)c1ccc(O)c(C(C)(C)C)c1.[NaH]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
ALOX15 P16050 4/20 0.64
HSD17B10 Q99714 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
HPGD P15428 2/20 0.64
LMNA P02545 3/20 0.61
TYR P14679 2/20 0.61
NR1I2 O75469 1/20 0.61
CYP2C9 P11712 1/20 0.61
MIF P14174 1/20 0.61
HTT P42858 1/20 0.61
NFE2L2 Q16236 1/20 0.61
MAPT P10636 3/20 0.57
GAA P10253 2/20 0.57
MEN1 O00255 1/20 0.57
PKM P14618 1/20 0.57
RECQL P46063 1/20 0.57
KMT2A Q03164 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL29364103 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL109921 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29614756 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL28420832 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
Fluoride SCHEMBL29290988 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL30621339 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
Hydrochloric Acid SCHEMBL4359705 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL30621342 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29851227 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD
Phosphine SCHEMBL28182001 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HSD17B10TDP1HPGD

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-110862318-B Preparation method of tert-butyl substituted hydroxybenzoate 甘肃省化工研究院有限责任公司 2022-05-13 CN claimed
CN-110862318-A Preparation method of tert-butyl substituted hydroxybenzoate 甘肃省化工研究院有限责任公司 2020-03-06 CN claimed
US-7582787-B2 Charge control agent, manufacturing process thereof, charge control resin particles and toner for developing electrostatic images ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2009-09-01 US claimed
JP-10059897-A None JP disclosed
CN-110862318-B Preparation method of tert-butyl substituted hydroxybenzoate 甘肃省化工研究院有限责任公司 2022-05-13 CN disclosed
CN-110862318-A Preparation method of tert-butyl substituted hydroxybenzoate 甘肃省化工研究院有限责任公司 2020-03-06 CN disclosed
CN-104136533-B There is the flooring material resin combination of dimensional stability 乐金华奥斯有限公司 2016-08-24 CN disclosed
CN-102827205-A Preparation method of nucleating agent CHINA PETROLEUM & CHEMICAL 2012-12-19 CN disclosed
CN-102807474-A Preparation methods of substituted diaryl phenol, organophosphorus ester and organic phosphate CHINA PETROLEUM & CHEMICAL 2012-12-05 CN disclosed
CN-101942126-B Transparent antistatic polyethylene film master batch PETROCHINA CO LTD 2012-08-08 CN disclosed
CN-102408444-A Ultrasonic preparation method of fine transparent nucleating agent CHINA PETROLEUM & CHEMICAL 2012-04-11 CN disclosed
CN-102382359-A Preparation method of ultrafine organic phosphate nucleating agent CHINA PETROLEUM & CHEMICAL 2012-03-21 CN disclosed
CN-102382135-A Preparation method of organic phosphate polypropylene nucleating agent CHINA PETROLEUM & CHEMICAL 2012-03-21 CN disclosed
JP-H1059897-A PRODUCTION OF DIALKYLHYDROXYBENZOIC ACID MITSUI PETROCHEM IND LTD 1998-03-03 JP disclosed