SCHEMBL566675

SCHEMBL566675

CC(C)=CC(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.64
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
HDAC1 Q13547 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC3 O15379 1/20 0.55
NCOR2 Q9Y618 1/20 0.55
AKT1 P31749 2/20 0.54
MAPT P10636 4/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
GAA P10253 2/20 0.53
THRB P10828 1/20 0.53
RECQL P46063 2/20 0.50
CES2 O00748 2/20 0.50
CES1 P23141 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.49

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
SCHEMBL10984957 0.86 NFE2L2 (0.64) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL10984963 0.86 NFE2L2 (0.64) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL566978 0.84 NFE2L2 (0.61) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL280061 0.84 NFE2L2 (0.61) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL29423291 0.84 NFE2L2 (0.61) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL566977 0.84 NFE2L2 (0.61) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL1133764 0.84 NFE2L2 (0.61) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL7312097 0.82 NFE2L2 (0.59) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL9435250 0.82 NFE2L2 (0.59) NFE2L2MEN1KMT2AALDH1A1MAPK1
SCHEMBL10766862 0.82 NFE2L2 (0.59) NFE2L2MEN1KMT2AALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318085-B2 Methods and compositions for inhibiting metal corrosion HALLIBURTON ENERGY SERVICES, INC. (US) 2012-11-27 US claimed
US-20120035086-A1 Methods and Compositions for Inhibiting Metal Corrosion HALLIBURTON ENERGY SERVICES, INC. (US) 2012-02-09 US claimed
US-8062586-B2 Methods and compositions for inhibiting metal corrosion HALLIBURTON ENERGY SERVICES, INC. (US) 2011-11-22 US claimed
US-20100087340-A1 Methods and Compositions for Inhibiting Metal Corrosion HALLIBURTON ENERGY SERVICES, INC. 2010-04-08 US claimed
US-20050123437-A1 Methods and compositions for inhibiting metal corrosion HALLIBURTON ENERGY SERVICES, INC. 2005-06-09 US claimed
US-20220009153-A1 COMPOSITION FOR FORMING PATTERN, KIT, CURED FILM, LAMINATE, PATTERN PRODUCING METHOD, AND METHOD FOR MANUFACTURING SEMICONDUCTOR ELEMENT FUJIFILM CORPORATION (JP) 2022-01-13 US disclosed
US-9707205-B2 S1P receptors modulators and their use thereof AKAAL PHARMA PTY LTD. (AU) 2017-07-18 US disclosed
EP-1572113-B1 CALCIUM RECEPTOR MODULATING COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2017-05-17 EP disclosed
EP-1572113-B1 CALCIUM RECEPTOR MODULATING COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2017-05-17 EP disclosed
US-9447100-B2 Substituted pyrazolo[1,5-A] pyrimidines as calcium receptor modulating agents TAKEDA PHARMACEUTICAL COMPANY, LTD. (JP) 2016-09-20 US disclosed
US-9447100-B2 Substituted pyrazolo[1,5-A] pyrimidines as calcium receptor modulating agents TAKEDA PHARMACEUTICAL COMPANY, LTD. (JP) 2016-09-20 US disclosed
US-9447100-B2 Substituted pyrazolo[1,5-A] pyrimidines as calcium receptor modulating agents TAKEDA PHARMACEUTICAL COMPANY, LTD. (JP) 2016-09-20 US disclosed
US-20010051726-A1 Method for producing 2-sulfonylpyridine derivatives and method for producing 2- { [ (2-pyridyl) methyl] thio} -1H-benzimidazole derivatives KURARAY CO., LTD. (JP) 2001-12-13 US disclosed
US-6197962-B1 REACTING A,B-UNSATURATED CARBONYL COMPOUND WITH A SULFONYL CYANIDE; CYCLIZATION KURARAY CO., LTD. (JP) 2001-03-06 US disclosed
EP-0931790-A2 Method for producing 2-sulfonylpyridine derivates and method for producing 2-( (2-pyridyl)methyl)thio)-1H-benzimidazole derivates KURARAY CO., LTD. (JP) 1999-07-28 EP disclosed
EP-0073301-B1 PROCESS FOR THE PREPARATION OF ALPHA, BETA AND BETA, GAMMA UNSATURATED KETONES FIRMENICH SA (CH) 1984-11-21 EP disclosed
US-4453011-A BASIFICATION OF A DIALLYL CARBINOL FIRMENICH SA (CH) 1984-06-05 US disclosed
EP-0073301-A1 Process for the preparation of alpha, beta and beta, gamma unsaturated ketones FIRMENICH SA (CH) 1983-03-09 EP disclosed
US-4289914-A FREE RADICAL POLYMERIZATION INITIATORS, CURING AGENTS FOR UNSATURATED POLYESTERS PENNWALT CORPORATION (US) 1981-09-15 US disclosed
US-4257985-A Compounds by addition of hydroperoxides to α-β-unsaturated ketones PENNWALT CORPORATION (US) 1981-03-24 US disclosed

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-20010051726-A1 Method for producing 2-sulfonylpyridine derivatives and method for producing 2- { [ (2-pyridyl) methyl] thio} -1H-benzimidazole derivatives PDXK, KCNJ2, KCNJ1 NFE2L2 775/4885MEN1 966/4885KMT2A 1201/4885

“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.