SCHEMBL71249

SCHEMBL71249

Cc1cc(C(=O)O)cc(C(=O)O)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 2/20 0.50
KDM4E B2RXH2 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HCAR1 Q9BXC0 1/20 0.43
ALDH1A1 P00352 3/20 0.43
GPR35 Q9HC97 1/20 0.42
PKM P14618 1/20 0.41
NOTUM Q6P988 2/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
TTR P02766 1/20 0.41
HSD17B10 Q99714 3/20 0.40
MYC P01106 1/20 0.40
ESR1 P03372 1/20 0.40

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
SCHEMBL3097749 0.88 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
Toluic Acid SCHEMBL27440416 0.87 ALDH1A1 (0.50) KDM4ETDP1MEN1KMT2AALDH1A1
Fluoride SCHEMBL11641082 0.86 TPMT (0.54) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL1572119 0.85 TPMT (0.59) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL6912583 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL6909433 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL6916910 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL6908978 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
SCHEMBL6909846 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A
Hydrochloric Acid SCHEMBL10831952 0.83 TPMT (0.56) TPMTKDM4ETDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458982-A Indazole compounds as irak4 inhibitors 奥列基因发现技术有限公司 2017-02-22 CN claimed
CN-102791715-B As the tricyclic compound of kinase inhibitor FUNDACION CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III (ES) 2016-04-27 CN claimed
CN-102448941-B The isoquinilone derivatives replaced D. WESTERN THERAPEUTICS INSTITUTE, INC. (JP) 2016-04-06 CN claimed
CN-102448941-A Substituted isoquinoline derivatives WESTERN THERAPEUTICS INST INC D 2012-05-09 CN claimed
CN-1882542-B 2-pyridone derivatives as inhibitors of neutrophil elastase and uses thereof ASTRAZENECA AB 2011-11-09 CN claimed
CN-101360498-A Calcilytic compounds SMITHKLINE BEECHAM CORP (US) 2009-02-04 CN claimed
EP-3230339-B1 EPOXY RESIN COMPOSITION, PREPREG, FIBER-REINFORCED PLASTIC MATERIAL, AND MANUFACTURING METHOD FOR FIBER-REINFORCED PLASTIC MATERIAL TORAY INDUSTRIES (JP) 2022-03-23 EP disclosed
CN-105503832-B Substituted pyrazolecarboxylic ring analog derivative and application thereof 浙江大学 2018-03-27 CN disclosed
CN-107709461-A LED reflection plate daiamid composition, LED reflection plate, the light-emitting device for possessing the reflecting plate 株式会社可乐丽 2018-02-16 CN disclosed
CN-107531690-A The amines of 4,5,6,7 tetrahydrochysene 1H pyrazolos [4,3 c] pyridine 3 as CBP and/or EP300 inhibitor 基因泰克公司 2018-01-02 CN disclosed
US-20170362376-A1 EPOXY RESIN COMPOSITION, PREPREG, FIBER-REINFORCED PLASTIC MATERIAL, AND MANUFACTURING METHOD FOR FIBER-REINFORCED PLASTIC MATERIAL TORAY INDUSTRIES, INC. (JP) 2017-12-21 US disclosed
EP-3230339-A1 EPOXY RESIN COMPOSITION, PREPREG, FIBER-REINFORCED PLASTIC MATERIAL, AND MANUFACTURING METHOD FOR FIBER-REINFORCED PLASTIC MATERIAL Toray Industries, Inc. (JP) 2017-10-18 EP disclosed
CN-106458982-A Indazole compounds as irak4 inhibitors 奥列基因发现技术有限公司 2017-02-22 CN disclosed
CN-100439339-C 2-pyridone derivatives as netrophil elastase inhibitors and their use. ASTRAZENECA AB (SE) 2008-12-03 CN disclosed
CN-101291669-A Use of azabicyclo hexane derivatives GLAXO GROUP LTD (GB) 2008-10-22 CN disclosed
CN-1946714-A Azabicyclo (3.1.0) hexane derivatives useful as modulators of dopamine d3 receptors GLAXO GROUP LTD (GB) 2007-04-11 CN disclosed
CN-1882542-A 2-pyridone derivatives as inhibitors of neutrophil elastase and uses thereof ASTRAZENECA AB (SE) 2006-12-20 CN disclosed
CN-1856467-A 2-pyridone derivatives as inhibitors of neutrophil elastase and uses thereof ASTRAZENECA AB (SE) 2006-11-01 CN disclosed
US-4423204-A HEAT RESISTANCE MOLDING MATERIALS THE UPJOHN COMPANY (US) 1983-12-27 US disclosed
US-3983230-A HALF ESTERS WITH DICARBOXYLIC ACIDS, MEDICAMENTS SHIONOGI & CO., LTD. (JA) 1976-09-28 US disclosed