SCHEMBL582322

SCHEMBL582322

COc1ccc(CNC(=O)c2ccccc2)cc1OC

nearest known ligand 0.85

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.85
NR1H4 Q96RI1 1/20 0.68
ALDH1A1 P00352 1/20 0.68
APEX1 P27695 1/20 0.64
RECQL P46063 1/20 0.64
HSD17B10 Q99714 1/20 0.64
LMNA P02545 1/20 0.64
ROCK2 O75116 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
NAMPT P43490 1/20 0.63

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
SCHEMBL17194791 0.92 SMN1; SMN2 (1.00) SMN1; SMN2NR1H4RECQLHSD17B10LMNA
SCHEMBL5681720 0.89 ERCC1 (0.69) SMN1; SMN2
SCHEMBL30646461 0.89 ERCC1 (0.69) SMN1; SMN2NR1H4L3MBTL1
SCHEMBL12172992 0.89 SMN1; SMN2 (0.68) SMN1; SMN2NR1H4LMNAROCK2L3MBTL1
SCHEMBL30613373 0.87 SMN1; SMN2 (0.67) SMN1; SMN2NR1H4ALDH1A1LMNAL3MBTL1
SCHEMBL29356619 0.86 ALDH1A1 (0.77) SMN1; SMN2ALDH1A1NAMPT
SCHEMBL6270935 0.86 ALDH1A1 (0.77) SMN1; SMN2ALDH1A1NAMPT
SCHEMBL28859140 0.85 NR1H4 (0.82) SMN1; SMN2NR1H4ALDH1A1LMNAROCK2
SCHEMBL12697047 0.85 SMN1; SMN2 (0.64) SMN1; SMN2NR1H4LMNAL3MBTL1
SCHEMBL6848908 0.85 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1LMNAL3MBTL1NAMPT

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-1633714-A1 2-AMINO-PYRIDINE DERIVATIVES AS BETA-2 ADRENORECEPTOR AGONISTS Pfizer Limited (GB) 2006-03-15 EP claimed
WO-2004108675-A1 2-AMINO-PYRIDINE DERIVATIVES AS BETA-2 ADRENORECEPTOR AGONISTS PFIZER LIMITED (GB) 2004-12-16 WO claimed
US-8530506-B2 Process for production of biphenyl derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-09-10 US disclosed
US-8530506-B2 Process for production of biphenyl derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-09-10 US disclosed
EP-2502919-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2012-09-26 EP disclosed
US-20120232283-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-09-13 US disclosed
EP-2417130-A2 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND VARIOUS THERAPEUTIC USES THEREOF SANOFI (FR) 2012-02-15 EP disclosed
WO-2011061996-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE 田辺三菱製薬株式会社 (JP) 2011-05-26 WO disclosed
US-7019002-B2 Substituted on 8th position with benzoic acid, ester or amide groups; anticancer agents PHARMACIA & UPJOHN, S.P.A. (IT) 2006-03-28 US disclosed
EP-1633714-A1 2-AMINO-PYRIDINE DERIVATIVES AS BETA-2 ADRENORECEPTOR AGONISTS Pfizer Limited (GB) 2006-03-15 EP disclosed
WO-2004108675-A1 2-AMINO-PYRIDINE DERIVATIVES AS BETA-2 ADRENORECEPTOR AGONISTS PFIZER LIMITED (GB) 2004-12-16 WO disclosed
WO-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed
EP-0548217-B1 PROCESS FOR THE PREPARATION OF C-TERMINALLY AMIDATED PEPTIDES BUCHARDT OLE (DK) 1997-04-09 EP disclosed
US-5580751-A REACTING A PEPTIDE WITH A NUCLEOPHILIC AMINE IN THE PRESENCE OF TRYPSIN OR A CARBOXYPEPIDASE; NONENZYMATICALLY CLEAVING TO FORM THE PRODUCT CARLSBERG A/S (DK) 1996-12-03 US disclosed
EP-0548217-A1 PROCESS FOR THE PREPARATION OF C-TERMINALLY AMIDATED PEPTIDES. BUCHARDT OLE (DK) 1993-06-30 EP disclosed
WO-1992005271-A1 PROCESS FOR THE PREPARATION OF C-TERMINALLY AMIDATED PEPTIDES BUCHARDT OLE (DK) 1992-04-02 WO 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 (1 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-20120232283-A1 PROCESS FOR PRODUCTION OF BIPHENYL DERIVATIVE AGTR2, AGTR1, ACE SMN1; SMN2 4872/4885NR1H4 130/4885ALDH1A1 906/4885

“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.