SCHEMBL2097649

SCHEMBL2097649

[O]C(=O)Nc1ccccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.62
HPGD P15428 1/20 0.62
CYP2C19 P33261 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
KDM4E B2RXH2 3/20 0.55
MAPT P10636 3/20 0.53
POLB P06746 2/20 0.53
LMNA P02545 2/20 0.53
TAS1R3 Q7RTX0 1/20 0.53
TAS1R1 Q7RTX1 1/20 0.53
TAS1R2 Q8TE23 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL6859262 0.84 CYP1A2 (0.64) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL10458447 0.84 KDM4E (0.72) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL2094293 0.83 MEN1 (0.69) CYP1A2HPGDMEN1KMT2ANPC1
SCHEMBL2175829 0.82 CYP1A2 (0.75) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL29537172 0.82 CYP1A2 (0.75) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL2097652 0.82 CYP1A2 (0.62) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL9311985 0.80 KMT2A (0.75) CYP1A2HPGDCYP2C19MEN1KMT2A
Fluoride SCHEMBL11753083 0.80 CYP1A2 (0.60) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL646296 0.80 HPGD (0.66) CYP1A2HPGDCYP2C19MEN1KMT2A
SCHEMBL5188311 0.80 CYP1A2 (0.60) CYP1A2HPGDCYP2C19MEN1KMT2A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4960874-A DYEING CELLULOSE ESTERS AND POLYESTERS BASF AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
US-4772292-A Mixture of yellow disperse dyestuffs containing pyridone disazo dye CASSELLA AKTIENGESELLSCHAFT (DE) 1988-09-20 US claimed
EP-0087616-B1 ISOTHIAZOLAZO DYESTUFFS BASF Aktiengesellschaft (DE) 1986-02-05 EP claimed
EP-0087616-A1 Isothiazolazo dyestuffs BASF Aktiengesellschaft (DE) 1983-09-07 EP claimed
US-4154577-A Uniformly disperse dyed water-swellable cellulosic fibers BASF AKTIENGESELLSCHAFT (DE) 1979-05-15 US claimed
US-4150943-A Uniformly dyed water-swellable cellulosic fibers BASF AKTIENGESELLSCHAFT (DE) 1979-04-24 US claimed
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-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
CN-1878777-A 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2006-12-13 CN disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed
US-4424154-A Azo dye having a 3-cyano- or 3-carbamoyl-2,6-diaminopyridine coupling component BASF AKTIENGESELLSCHAFT (DE) 1984-01-03 US disclosed
EP-0023309-A1 Disazo dyestuffs of the aminopyridine or aminopyrimidine series and their use in dyeing textile material containing cellulose BASF Aktiengesellschaft (DE) 1981-02-04 EP disclosed
US-4157893-A MONO OR DISAZO DYE CONTAINING AN AMINO-SUBSTITUTED PYRIMIDINE RING BASF AKTIENGESELLSCHAFT (DE) 1979-06-12 US disclosed
US-4154577-A Uniformly disperse dyed water-swellable cellulosic fibers BASF AKTIENGESELLSCHAFT (DE) 1979-05-15 US disclosed
US-4150943-A Uniformly dyed water-swellable cellulosic fibers BASF AKTIENGESELLSCHAFT (DE) 1979-04-24 US disclosed
US-4146535-A Azo dyes having a 3-cyano- or 3-carbamoyl-2,6-diamino-pyridine coupling component BASF AKTIENGESELLSCHAFT (DE) 1979-03-27 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-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 CYP1A2 420/4885HPGD 1951/4885CYP2C19 1894/4885

“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.