SCHEMBL792991

SCHEMBL792991

NC(=O)n1c(=O)[nH]c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.56
POLB P06746 1/20 0.47
MEN1 O00255 1/20 0.47
CYP1A2 P05177 1/20 0.47
KMT2A Q03164 1/20 0.47
HSP90AA1 P07900 2/20 0.43

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
Hydrochloric Acid SCHEMBL3925843 0.98 DAO (0.55) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL7702540 0.98 DAO (0.55) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL11431122 0.85 DAO (0.60) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL6069428 0.84 DAO (0.55) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL444120 0.83 DAO (0.58) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL26352125 0.82 GRIA1 (0.51) DAOPOLB
SCHEMBL11691177 0.81 DAO (0.56) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL7596452 0.81 DAO (0.56) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL14701887 0.81 DAO (0.56) DAOPOLBMEN1CYP1A2KMT2A
SCHEMBL2924922 0.81 DAO (0.56) DAOPOLBMEN1CYP1A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002030886-A2 HETEROCYCLIC ANGIOGENESIS INHIBITORS MATTHEWS BARRY R (AU) 2002-04-18 WO claimed
US-20130158092-A1 New Oral Formulation NOVARTIS AG (CH) 2013-06-20 US disclosed
US-8252815-B2 Nociceptin analogs PURDUE PHARMA L.P. (US) 2012-08-28 US disclosed
US-20120095049-A1 NOCICEPTIN ANALOGS PURDUE PHARMA L.P. (US) 2012-04-19 US disclosed
US-20120071537-A1 New Oral Formulation DE BRUIJN KAREL (FR) 2012-03-22 US disclosed
EP-2358702-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK Holdings Co., Ltd. (KR) 2011-08-24 EP disclosed
US-7939670-B2 Nociceptin analogs PURDUE PHARMA L.P. (US) 2011-05-10 US disclosed
EP-1902053-B1 BENZOIMIDAZOLONE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE INC (US) 2011-01-12 EP disclosed
WO-2010044585-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK HOLDINGS CO., LTD. (KR) 2010-04-22 WO disclosed
EP-1960396-B1 CARBAMATE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE INC (US) 2009-11-11 EP disclosed
EP-1104289-A2 NEW ORAL FORMULATION FOR 5-HT4 AGONISTS OR ANTAGONISTS Novartis AG (CH) 2001-06-06 EP disclosed
US-6117882-A 5-HT4 agonists and antagonists ELI LILLY AND COMPANY (US) 2000-09-12 US disclosed
US-6069152-A NERVOUS SYSTEM DISORDERS; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS ELI LILLY AND COMPANY (US) 2000-05-30 US disclosed
WO-2000010526-A2 NEW ORAL FORMULATION FOR 5-HT4 AGONISTS OR ANTAGONISTS NOVARTIS AG (CH) 2000-03-02 WO disclosed
WO-1999017772-A1 5HT4 AGONISTS AND ANTAGONISTS ELI LILLY AND COMPANY (US) 1999-04-15 WO disclosed
EP-0908459-A1 5-HT4 Agonists and antagonists ELI LILLY AND COMPANY (US) 1999-04-14 EP disclosed
US-5811432-A Azaoxindole derivatives PFIZER INC (US) 1998-09-22 US disclosed
WO-1994000454-A1 BENZIMIDAZOLE COMPOUNDS G.D. SEARLE & CO. (US) 1994-01-06 WO disclosed
WO-1991009598-A1 AZAOXINDOLE DERIVATIVES PFIZER INC. (US) 1991-07-11 WO disclosed
EP-0436333-A2 Azaoxindole derivatives PFIZER INC. (US) 1991-07-10 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 (3 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-20120071537-A1 New Oral Formulation ABCG2, SI, SLC10A2 DAO 2583/4885POLB 4732/4885MEN1 2219/4885
US-20130158092-A1 New Oral Formulation ABCG2, SI, SLC10A2 DAO 2583/4885POLB 4732/4885MEN1 2219/4885
US-20120095049-A1 NOCICEPTIN ANALOGS OPRL1, NPY1R, NPBWR1 DAO 2300/4885POLB 2777/4885MEN1 2539/4885

“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.