SCHEMBL673963

SCHEMBL673963

CCCCc1ccc(O)c(C(C)(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
RAB9A P51151 1/20 0.52
ALOX15 P16050 4/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 2/20 0.50
NR1I2 O75469 1/20 0.50
CYP2C9 P11712 1/20 0.50
MIF P14174 1/20 0.50
TYR P14679 1/20 0.50
NFE2L2 Q16236 1/20 0.50
KAT8 Q9H7Z6 2/20 0.47
HSP90AA1 P07900 1/20 0.47
HSP90AB1 P08238 1/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47

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
SCHEMBL29612324 1.00 HTT (0.52) HTTNPSR1NPC1HPGDMAPK1
Methane SCHEMBL27924017 0.98 HTT (0.50) HTTNPSR1NPC1HPGDMAPK1
SCHEMBL27685437 0.95 KAT8 (0.54) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL107937 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL28387660 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL994580 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL8975192 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL106675 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
SCHEMBL109409 0.93 KAT8 (0.56) HTTALOX15ALDH1A1LMNAHSD17B10
Water SCHEMBL27338163 0.92 KAT8 (0.55) HTTALOX15ALDH1A1LMNAHSD17B10

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 148 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109661415-A The method for reducing the aldehyde discharge of polyurethane foam 科思创德国股份有限公司 2019-04-19 CN claimed
US-9162969-B2 Nitrooxyesters, their preparation and use DSM IP ASSETS B.V. (NL) 2015-10-20 US claimed
US-8709110-B2 Use of carotenoid (ester)s DSM IP ASSETS B.V. (NL) 2014-04-29 US claimed
US-20120210634-A1 NITROOXYESTERS, THEIR PREPARATION AND USE DSM IP ASSETS B.V. (NL) 2012-08-23 US claimed
CN-102382135-A Preparation method of organic phosphate polypropylene nucleating agent CHINA PETROLEUM & CHEMICAL 2012-03-21 CN claimed
CN-101367833-B Preparation method for organic phosphate nucleating agent CHINA PETROCHEMICAL CO LTD 2011-06-15 CN claimed
US-20110119995-A1 NOVEL USE OF CAROTENOID (ESTER)S DSM IP ASSETS B.V. (NL) 2011-05-26 US claimed
CN-102040628-A Method for preparing polypropylene nucleating agent CHINA PETROLEUM & CHEMICAL 2011-05-04 CN claimed
CN-102040629-A Method for preparing organic phosphate nucleating agent CHINA PETROLEUM & CHEMICAL 2011-05-04 CN claimed
CN-101423624-B Miniaturization organic phoshate nucleating agent and preparation method thereof CHINA PETROLEUM & CHEMICAL 2011-05-04 CN claimed
WO-2007089645-A2 BIODIESEL FUEL ADDITIVE ORYXE ENERGY INTERNATIONAL, INC. (US) 2007-08-09 WO claimed
US-20060201056-A1 Biodiesel fuel additive ORYXE ENERGY INTERNATIONAL, INC. (US) 2006-09-14 US claimed
CN-1185240-C Process for one-stage synthesizing substituted diaryl organic metal phosphate SHANGHAI SHENGLIN NEW MATERIAL (CN) 2005-01-19 CN claimed
CN-1358728-A Process for one-stage synthesizing substituted diaryl organic metal phosphate SHANGHAI CHENGLIN NEW MATERIAL (CN) 2002-07-17 CN claimed
CN-1032362-C Method of stabilizing oxymethylene copolymer UBE INDUSTRIES (JP) 1996-07-24 CN claimed
EP-0427456-B1 STABILIZER COMPOSITIONS ETHYL CORPORATION (US) 1993-09-01 EP claimed
US-5076814-A Stabilizer compositions ETHYL CORPORATION (US) 1991-12-31 US claimed
US-5024775-A Alkyl phenol stabilizer compositions for fuels and lubricants ETHYL CORPORATION (US) 1991-06-18 US claimed
EP-0427456-A1 Stabilizer compositions ETHYL CORPORATION (US) 1991-05-15 EP claimed
CN-1039814-A The method of stabilized oxymethylene copolymer UBE INDUSTRIES (JP) 1990-02-21 CN claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120210634-A1 NITROOXYESTERS, THEIR PREPARATION AND USE CYP2E1, CYP1B1, CYP11B1 HTT 4115/4885NPSR1 1703/4885NPC1 1178/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.