SCHEMBL4638741

SCHEMBL4638741

NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.76
MAOB P27338 6/20 0.74
MAOA P21397 3/20 0.74
SMPD1 P17405 1/20 0.66
F2 P00734 2/20 0.61
RXRA P19793 1/20 0.59
RXRB P28702 1/20 0.59
RXRG P48443 1/20 0.59
HPD P32754 1/20 0.58
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
MRGPRX4 Q96LA9 1/20 0.56
PARP10 Q53GL7 1/20 0.55

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 SCHEMBL5177543 0.99 NR4A2 (0.74) NR4A2MAOBMAOASMPD1F2
SCHEMBL15452539 0.87 NR4A2 (0.77) NR4A2MAOBMAOAF2RXRA
SCHEMBL7442228 0.87 F2 (0.63) NR4A2MAOBMAOASMPD1F2
SCHEMBL7052037 0.87 NR4A2 (1.00) NR4A2MAOBMAOASMPD1RXRA
SCHEMBL1387246 0.86 NR4A2 (0.77) NR4A2MAOBSMPD1F2MEN1
SCHEMBL4640232 0.85 NR4A2 (0.76) NR4A2MAOBMAOAF2HPD
SCHEMBL4638697 0.85 MAOB (0.74) NR4A2MAOBMAOASMPD1F2
SCHEMBL4639668 0.85 MAOB (0.76) NR4A2MAOBMAOAF2HPD
SCHEMBL7451063 0.85 NR4A2 (0.70) NR4A2MAOBSMPD1F2RXRA
SCHEMBL1436284 0.85 MAOB (1.00) NR4A2MAOBMAOASMPD1RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP claimed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP claimed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO claimed
JP-57149254-A None JP disclosed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP disclosed
EP-1844020-B1 HETEROCYCLIC CARBOXAMIDE COMPOUNDS AS STEROID NUCLEAR RECEPTOR LIGANDS EXELIXIS INC (US) 2017-09-06 EP disclosed
US-8367667-B2 Pyrrole derivatives as pharmaceutical agents EXELIXIS, INC. (US) 2013-02-05 US disclosed
US-20110301128-A1 Pyrrole Derivatives As Pharmaceutical Agents EXELIXIS, INC. (US) 2011-12-08 US disclosed
US-20080234270-A1 Pyrrole Derivatives As Pharmaceutical Agents EXELIXIS, INC. (US) 2008-09-25 US disclosed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP disclosed
EP-1844020-A1 HETEROCYCLIC CARBOXAMIDE COMPOUNDS AS STEROID NUCLEAR RECEPTOR LIGANDS Exelixis, Inc. (US) 2007-10-17 EP disclosed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP disclosed
WO-2006076202-A1 HETEROCYCLIC CARBOXAMIDE COMPOUNDS AS STEROID NUCLEAR RECEPTORS LIGANDS EXELIXIS, INC. (US) 2006-07-20 WO disclosed
WO-2006012642-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS, INC. (US) 2006-02-02 WO disclosed
JP-S57149254-A M-BENZYLOXYBENZAMIDE DERIVATIVE AND HERBICIDE CONTAINING THE SAME HODOGAYA CHEM CO LTD 1982-09-14 JP 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-20110301128-A1 Pyrrole Derivatives As Pharmaceutical Agents PRLHR, PTGDR, TACR1 NR4A2 416/4885MAOB 654/4885MAOA 686/4885
US-20080234270-A1 Pyrrole Derivatives As Pharmaceutical Agents PRLHR, PTGDR, TACR1 NR4A2 416/4885MAOB 654/4885MAOA 686/4885

“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.