SCHEMBL1027400

SCHEMBL1027400

CC(C)c1ccc(NC(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.61
RAB9A P51151 8/20 0.58
SMN1; SMN2 Q16637 6/20 0.58
HPGD P15428 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
EGFR P00533 1/20 0.56
CRHBP P24387 1/20 0.56
CRHR2 Q13324 1/20 0.56
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
NPC1 O15118 6/20 0.54
LMNA P02545 3/20 0.54
MAPT P10636 1/20 0.54
EPHX1 P07099 2/20 0.53
TP53 P04637 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51

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
SCHEMBL28905039 0.87 KIF11 (0.47) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL4088865 0.85 EGFR (0.48) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL19707622 0.84 RAB9A (0.76) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL7479983 0.83 NR1H4 (0.59) KIF11SMN1; SMN2MEN1KMT2ACRHBP
SCHEMBL12894479 0.83 KIF11 (0.58) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL4638093 0.83 RAB9A (0.58) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL2096251 0.83 KIF11 (0.61) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL104524 0.83 SMN1; SMN2 (0.61) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL4105821 0.82 RAB9A (0.67) KIF11RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL11124866 0.82 HSD17B10 (0.51) RAB9ASMN1; SMN2HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0068295-B1 A NEW HERBICIDAL COMPOSITION, PROCESSES FOR ITS PRODUCTION AND ITS USE A. Nattermann & Cie. GmbH (DE) 1985-08-28 EP claimed
EP-0068295-A1 A new herbicidal composition, processes for its production and its use A. Nattermann & Cie. GmbH (DE) 1983-01-05 EP claimed
US-20150144521-A1 STORAGE AIDS COMPRISING PLANT PROTECTANTS AND THEIR USE RKW SE (DE) 2015-05-28 US disclosed
US-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof QR PHARMA, INC. 2013-04-18 US disclosed
US-20130017582-A1 ENHANCED PRODUCTION OF TAXOL AND TAXANES BY CELL CULTURES OF TAXUS SPECIES PHYTON HOLDINGS, LLC (US) 2013-01-17 US disclosed
US-8338143-B2 Enhanced production of paclitaxel and taxanes by cell cultures of Taxus species PHYTON HOLDINGS, LLC (US) 2012-12-25 US disclosed
WO-2012058031-A2 NOVEL METHOD FOR PREPARATION OF BISNORCYMERINE AND SALTS THEREOF QR PHARMA, INC. (US) 2012-05-03 WO disclosed
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
CN-101490004-B Derivatives of 1-phenyl-2-pyridynyl alkylene alcohols as phosphodiesterase inhibitors CHIESI FARMA SPA 2012-01-11 CN disclosed
US-20110086397-A1 ENHANCED PRODUCTION OF TAXOL AND TAXANES BY CELL CULTURES OF TAXUS SPECIES PHYTON HOLDINGS, LLC (US) 2011-04-14 US disclosed
EP-2044023-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDYNYL ALKYLENE ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMA SPA (IT) 2011-01-19 EP disclosed
EP-0205271-B1 N-(3-CHLORO-4-ISOPROPYLPHENYL)CARBOXAMIDES, PROCESS FOR PRODUCING THEM, AND SELECTIVE HERBICIDES CONTAINING THEM MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-02-01 EP disclosed
US-4749812-A N-(3-chloro-4-isopropylphenyl) carboxamide derivative and selective herbicide MITSUI TOATSU CHEMICALS, INC. (JP) 1988-06-07 US disclosed
EP-0205271-A1 N-(3-chloro-4-isopropylphenyl)carboxamides, process for producing them, and selective herbicides containing them MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-17 EP disclosed
US-4390710-A A 4-AMINOPYRIDINE WITH A PYRIDINE PPG INDUSTRIES, INC. (US) 1983-06-28 US disclosed
EP-0068295-A1 A new herbicidal composition, processes for its production and its use A. Nattermann & Cie. GmbH (DE) 1983-01-05 EP disclosed
US-4308051-A HERBICIDES MITSUI TOATSU CHEMICALS, INC. (JP) 1981-12-29 US disclosed
US-4266070-A CARBONYLS OF COBALT, MOLYBDENUM, TITANIUM, RHODIUM, IRON, NICKEL AND IRIDIUM AS CATALYSTS FOR THE CARBONYLATION OF PRIMARY OR SECONDARY AMINES AND ALCOHOLS TO FORM CARBAMATES HALCON RESEARCH AND DEVELOPMENT CORP. (US) 1981-05-05 US disclosed
US-4029687-A HERBICIDES CIBA-GEIGY AG (CH) 1977-06-14 US disclosed
US-4004914-A HERBICIDES CIBA-GEIGY AG (CH) 1977-01-25 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 (2 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-20130096316-A1 Novel Method for Preparation of Bisnorcymerine and Salts Thereof PHOSPHO1, CBS, COASY KIF11 4105/4885RAB9A 2162/4885SMN1; SMN2 4422/4885
US-20150144521-A1 STORAGE AIDS COMPRISING PLANT PROTECTANTS AND THEIR USE ECPAS, BROX, TTPA KIF11 3732/4885RAB9A 2428/4885SMN1; SMN2 635/4885

“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.