SCHEMBL4172605

SCHEMBL4172605

O=C(O)Nc1ccccc1Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.70
ALDH1A1 P00352 4/20 0.53
HPGD P15428 2/20 0.53
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
MAOB P27338 1/20 0.51
PKM P14618 1/20 0.50
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MCOLN3 Q8TDD5 1/20 0.46
KDM4E B2RXH2 1/20 0.46
IDH1 O75874 1/20 0.45

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
SCHEMBL27547012 0.98 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDLMNAHTT
Hydrochloric Acid SCHEMBL11164652 0.98 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL4622869 0.90 L3MBTL1 (0.56) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL4237601 0.90 L3MBTL1 (0.62) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL4621396 0.90 L3MBTL1 (0.58) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL4237309 0.88 L3MBTL1 (0.56) L3MBTL1ALDH1A1LMNAHTTMAOB
SCHEMBL4242010 0.88 L3MBTL1 (0.56) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL2419022 0.87 L3MBTL1 (0.68) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL7522410 0.85 L3MBTL1 (0.71) L3MBTL1ALDH1A1HPGDLMNAHTT
SCHEMBL2814913 0.85 L3MBTL1 (0.66) L3MBTL1ALDH1A1HPGDLMNAHTT

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-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US claimed
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US claimed
EP-1904446-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-04-02 EP claimed
WO-2007007282-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-18 WO claimed
WO-2007005887-A2 ANDROGEN RECEPTOR MODULATOR COMPOUNDS, COMPOSITIONS AND USES THEREOF LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-01-11 WO claimed
CN-111183130-A Benzoheterocyclic derivatives and pharmaceutical compositions containing the same 景凱生物科技股份有限公司 2020-05-19 CN disclosed
US-20090227571-A1 Androgen Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED 2009-09-10 US disclosed
US-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US disclosed
EP-1904446-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2008-04-02 EP disclosed
WO-2007007282-A2 AZABICYCLO DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-18 WO disclosed
US-4782080-A ANALGESIC, ANTIINFLAMMATORY MERCK & CO., INC. (US) 1988-11-01 US disclosed
US-4771032-A PHOTODECOMPOSING COLORING COMPONENTS COMPRISING A DIAZO COMPOUND AND COUPLER FUJI PHOTO FILM CO., LTD. (JP) 1988-09-13 US disclosed
EP-0014103-B1 IMPROVED PROCESS FOR THE MANUFACTURE OF CARBAMATES THE HALCON SD GROUP, INC. (US) 1983-05-11 EP disclosed
US-4279637-A Herbicidal N-substituted 4-imidazolin-2-ones VELSICOL CHEMICAL CORPORATION (US) 1981-07-21 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-4260781-A Process for the manufacture of carbamates HALCON RESEARCH AND DEVELOPMENT CORP. (US) 1981-04-07 US disclosed
US-4258201-A CATALYTIC CARBONYLATION OF PRIMARY OR SECONDARY AMINES WITH CARBON MONOXIDE AND ALCOHOLS HALCON RESEARCH AND DEVELOPMENT CORP. (US) 1981-03-24 US disclosed
US-4242520-A ONE-STEP CARBONYLATION OF AMINES IN THE PRESENCE OF A DISULFIDE HALCON RESEARCH & DEVELOPMENT CORPORATION (US) 1980-12-30 US disclosed
EP-0014103-A2 Improved process for the manufacture of carbamates THE HALCON SD GROUP, INC. (US) 1980-08-06 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 (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-20090227571-A1 Androgen Receptor Modulator Compounds and Methods AR, NR5A1, ESRRA L3MBTL1 4784/4885ALDH1A1 1408/4885HPGD 781/4885
US-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 L3MBTL1 4211/4885ALDH1A1 1806/4885HPGD 870/4885

“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.