SCHEMBL1404741

SCHEMBL1404741

C=C(C)n1c(=O)n(CCCC(=O)O)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
ATM Q13315 1/20 0.54
FABP4 P15090 3/20 0.54
FABP5 Q01469 3/20 0.54
CMA1 P23946 6/20 0.47
CTSG P08311 2/20 0.47
APEX1 P27695 2/20 0.44
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TACR1 P25103 2/20 0.42
OPRM1 P35372 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
FABP3 P05413 1/20 0.42
ALDH1A1 P00352 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
SCHEMBL14664244 0.86 MEN1 (0.52) MEN1KMT2AATMFABP4FABP5
SCHEMBL14021860 0.85 MEN1 (0.51) MEN1KMT2AATMTACR1OPRM1
SCHEMBL13240513 0.84 MEN1 (0.50) MEN1KMT2AATMFABP4FABP5
SCHEMBL11094129 0.84 MEN1 (0.58) MEN1KMT2AATMCMA1APEX1
SCHEMBL1405053 0.83 TNF (0.59) MEN1KMT2AATML3MBTL1TACR1
SCHEMBL9385716 0.83 MEN1 (0.49) MEN1KMT2AATML3MBTL1TACR1
SCHEMBL507642 0.83 MEN1 (0.60) MEN1KMT2AATMHTTL3MBTL1
SCHEMBL508219 0.83 MEN1 (0.57) MEN1KMT2AATMAPEX1HTT
SCHEMBL10540522 0.83 MEN1 (0.54) MEN1KMT2AATML3MBTL1TACR1
SCHEMBL6217963 0.82 APEX1 (0.67) MEN1KMT2AATMAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11214551-B2 One pot synthesis of 4-(1,2-dihydro-2-oxobenzo[d]imidazol-3-yl)butanoic acid, a key intermediate of zilpaterol RA CHEM PHARMA LIMITED (IN) 2022-01-04 US disclosed
US-20210238146-A1 ONE POT SYNTHESIS OF 4-(1,2-DIHYDRO-2-OXOBENZO[D]IMIDAZOL-3-YL)BUTANOIC ACID, A KEY INTERMEDIATE OF ZILPATEROL COHANCE LIFESCIENCES LIMITED (IN) 2021-08-05 US disclosed
EP-2935275-B9 AN IMPROVED PROCESS FOR MAKING ZILPATEROL INTERVET INT BV (NL) 2017-10-11 EP disclosed
US-9630967-B2 Process for making zilpaterol INTERVET INC. (US) 2017-04-25 US disclosed
EP-2935275-B1 AN IMPROVED PROCESS FOR MAKING ZILPATEROL INTERVET INT BV (NL) 2017-03-08 EP disclosed
EP-2535340-B1 Process for making zilpaterol and salts thereof INTERVET INT BV (NL) 2016-04-27 EP disclosed
US-20150315195-A1 AN IMPROVED PROCESS FOR MAKING ZILPATEROL INTERVET INC. (US) 2015-11-05 US disclosed
EP-2142553-B1 PROCESSES FOR MAKING ZILPATEROL AND SALTS THEREOF INTERVET INT BV (NL) 2015-08-19 EP disclosed
EP-2109614-B1 ENANTIOSELECTIVE SYNTHESIS OF 6-AMINO-7-HYDROXY-4, 5, 6, 7-TETRAHYDRO-IMIDAZO [4, 5, 1-JK][1]-BENZAZEPIN-2 [1H]-ONE AND ZILPATEROL INTERVET INT BV (NL) 2014-08-06 EP disclosed
WO-2014095822-A1 AN IMPROVED PROCESS FOR MAKING ZILPATEROL INTERVET INTERNATIONAL B.V. (NL) 2014-06-26 WO disclosed
WO-2008092924-A1 ENANTIOSELECTIVE SYNTHESIS OF 6-AMINO-7-HYDROXY-4, 5, 6, 7-TETRAHYDRO-IMIDAZO [4, 5, 1-JK] [1] -BENZAZEPIN-2 [1H] -ONE AND ZILPATEROL INTERVET INTERNATIONAL B.V. (NL) 2008-08-07 WO disclosed
US-20080161288-A1 COMPOUNDS PFIZER INC. 2008-07-03 US disclosed
US-20080161288-A1 COMPOUNDS PFIZER INC. 2008-07-03 US disclosed
US-20080161288-A1 COMPOUNDS PFIZER INC. 2008-07-03 US disclosed
WO-2008050207-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS PFIZER LIMITED (GB) 2008-05-02 WO disclosed
US-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality PFIZER LIMITED (GB) 2008-05-01 US disclosed
US-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality PFIZER LIMITED (GB) 2008-05-01 US disclosed
US-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality PFIZER LIMITED (GB) 2008-05-01 US disclosed
WO-2008044127-A1 HETEROCYCLIC COMPOUNDS USEFUL AS ANABOLIC AGENTS FOR LIVESTOCK ANIMALS PFIZER LIMITED (GB) 2008-04-17 WO disclosed
EP-0107569-A1 6-Amino-7-hydroxy-4,5,6,7-tetrahydroimidazo(4,5,1-j,k)(1)benzazepin-2(1H)-one derivatives, their salts, their preparation, their use as medicaments and compositions containing them ROUSSEL-UCLAF (FR) 1984-05-02 EP 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 (5 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-20080103130-A1 7-hydroxy-6-{[1-methyl-3-(1,3-thiazol-5-yl)propyl]amino}-4,5,6,7-tetrahydroimidazo[4,5,1-jk][1]benzazepin-2(1H)-one; agonists at the beta-2 adrenoceptor; feed additives for livestock animals; improving meat yield or meat quality ADRB2, ADRB1, ADRA2C MEN1 4157/4885KMT2A 1311/4885ATM 1871/4885
US-20210238146-A1 ONE POT SYNTHESIS OF 4-(1,2-DIHYDRO-2-OXOBENZO[D]IMIDAZOL-3-YL)BUTANOIC ACID, A KEY INTERMEDIATE OF ZILPATEROL CYP51A1, MED1, AZI2 MEN1 3073/4885KMT2A 967/4885ATM 4819/4885
US-11214551-B2 One pot synthesis of 4-(1,2-dihydro-2-oxobenzo[d]imidazol-3-yl)butanoic acid, a key intermediate of zilpaterol CYP51A1, MED1, AZI2 MEN1 3073/4885KMT2A 967/4885ATM 4819/4885
US-20080161288-A1 COMPOUNDS ADRB2, ADRB1, ADRA2C MEN1 3848/4885KMT2A 3393/4885ATM 3360/4885
US-20150315195-A1 AN IMPROVED PROCESS FOR MAKING ZILPATEROL PPIP5K2, PPIA, ITPA MEN1 3135/4885KMT2A 790/4885ATM 4856/4885

“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.