SCHEMBL1149577

SCHEMBL1149577

O=C(O)c1cc(CNCc2ccc(Cl)cc2)c[nH]1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.70
ALDH1A1 P00352 1/20 0.59
NOTUM Q6P988 1/20 0.54
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RAB9A P51151 3/20 0.43
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SNCA P37840 1/20 0.41
GRIN1 Q05586 1/20 0.41
CHRM2 P08172 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
HDAC1 Q13547 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
SCHEMBL1149794 0.84 DAO (0.64) DAOALDH1A1NOTUMMEN1KMT2A
SCHEMBL12858354 0.83 DAO (0.77) DAOALDH1A1NOTUMKMT2ARAB9A
SCHEMBL679780 0.83 DAO (1.00) DAONOTUMMEN1KMT2ARAB9A
SCHEMBL13614337 0.78 DAO (0.47) DAOALDH1A1NOTUMRAB9ANPC1
SCHEMBL28058907 0.76 DAO (0.66) DAOALDH1A1NOTUMMEN1KMT2A
SCHEMBL8283551 0.73 RAB9A (0.76) DAOALDH1A1NOTUMMEN1KMT2A
SCHEMBL1149578 0.72 DAO (0.61) DAOALDH1A1NOTUMRAB9ANPC1
SCHEMBL1149694 0.72 DAO (0.49) DAORAB9AGAA
SCHEMBL415949 0.72 CHRM2 (0.67) ALDH1A1MEN1KMT2ACYP2C9CYP2C19
SCHEMBL12704172 0.71 DAO (0.73) DAONOTUMRAB9AGRIN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110092559-A1 PYRROLE AND PYRAZOLE DAAO INHIBITORS SUNOVION PHARMACEUTICALS INC. (US) 2011-04-21 US disclosed
US-7893098-B2 Pyrrole and pyrazole DAAO inhibitors SEPRACOR INC. (US) 2011-02-22 US disclosed
US-20100016397-A1 Pyrrole and Pyrazole DAAO Inhibitors SEPRACOR INC. (US) 2010-01-21 US disclosed
US-7615572-B2 4,5-substituted pyrazole-3-carboxylic acids/esters/salts; D-amino acid oxidase (DAAO) inhibitors; increase D-Serine level; reduce level of toxic products of D-Serine oxidation; activate N-methyl-D-aspartate NMDA-glutamate receptors; neuropathic agent, schizophrenia, Alzheimer's, anaxia SEPRACOR INC. (US) 2009-11-10 US disclosed
US-20090170916-A1 Pyrrole and Pyrazole DAAO Inhibitors SEPRACOR INC. (US) 2009-07-02 US disclosed
US-7488747-B2 Pyrrole and pyrazole DAAO inhibitors SEPRACOR INC. (US) 2009-02-10 US disclosed
EP-1709004-A2 PYRROLE AND PYRAZOLE DAAO INHIBITORS Sepracor Inc. (US) 2006-10-11 EP disclosed
WO-2005066135-A2 PYRROLE AND PYRAZOLE DAAO INHIBITORS SEPRACOR INC. (US) 2005-07-21 WO disclosed
US-20050143443-A1 Pyrrole and pyrazole DAAO inhibitors SEPRACOR INC. (US) 2005-06-30 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 (4 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-20110092559-A1 PYRROLE AND PYRAZOLE DAAO INHIBITORS DDO, DAO, SRR DAO 2/4885ALDH1A1 3634/4885NOTUM 1575/4885
US-20100016397-A1 Pyrrole and Pyrazole DAAO Inhibitors DDO, DAO, SRR DAO 2/4885ALDH1A1 3634/4885NOTUM 1575/4885
US-20050143443-A1 Pyrrole and pyrazole DAAO inhibitors DDO, DAO, SRR DAO 2/4885ALDH1A1 3634/4885NOTUM 1575/4885
US-20090170916-A1 Pyrrole and Pyrazole DAAO Inhibitors DDO, DAO, SRR DAO 2/4885ALDH1A1 3634/4885NOTUM 1575/4885

“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.