SCHEMBL914760

SCHEMBL914760

CCOc1ccc(C)c(-c2ccc(C(=O)NC3(C(=O)OC)CCCCC3)nc2-c2ccc(Cl)c(OCCCN(C)C)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PAICS P22234 4/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
SENP2 Q9HC62 2/20 0.32
SENP1 Q9P0U3 2/20 0.32
KDR P35968 3/20 0.32
PDE5A O76074 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE7A Q13946 1/20 0.32
AGER Q15109 1/20 0.32
HSP90AB1 P08238 1/20 0.32
LPAR1 Q92633 1/20 0.32
HTR1A P08908 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
UTS2R Q9UKP6 1/20 0.31
CTSA P10619 2/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL913456 0.95 PAICS (0.34) PAICSKDRPDE5APDE4DPDE7A
SCHEMBL2488721 0.94 FFAR1 (0.35) PAICSFFAR1FFAR4SENP2SENP1
Hydrochloric Acid SCHEMBL544715 0.94 FFAR1 (0.35) PAICSFFAR1FFAR4SENP2SENP1
SCHEMBL912863 0.93 PAICS (0.33) PAICSFFAR1FFAR4SENP2SENP1
SCHEMBL912866 0.93 PAICS (0.33) PAICSFFAR1FFAR4SENP2SENP1
SCHEMBL912865 0.93 PAICS (0.33) PAICSFFAR1FFAR4SENP2SENP1
SCHEMBL913461 0.93 PAICS (0.33) PAICSFFAR4SENP2SENP1KDR
SCHEMBL912796 0.92 SMYD2 (0.34) PAICSFFAR1FFAR4PDE5APDE4D
SCHEMBL913384 0.91 KDR (0.34) PAICSFFAR4KDRPDE5APDE4D
SCHEMBL913392 0.90 PAICS (0.35) PAICSFFAR1FFAR4PDE5APDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8466292-B2 5,6-bisaryl-2-pyridine-carboxamide derivatives, preparation thereof and therapeutic application thereof as urotensin II receptor antagonists SANOFI (FR) 2013-06-18 US claimed
EP-2238110-B1 5.6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS ANTAGONISTS FOR UROTENSINE II RECEPTORS SANOFI SA (FR) 2011-10-26 EP claimed
US-20110009426-A1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2011-01-13 US claimed
US-8653276-B2 5,6-bisaryl-2-pyridine-carboxamide derivatives, preparation thereof and therapeutic application thereof as urotensin II receptor antagonists SANOFI (FR) 2014-02-18 US disclosed
US-20130252974-A1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS SANOFI (FR) 2013-09-26 US disclosed
US-8466292-B2 5,6-bisaryl-2-pyridine-carboxamide derivatives, preparation thereof and therapeutic application thereof as urotensin II receptor antagonists SANOFI (FR) 2013-06-18 US disclosed
US-20110009426-A1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2011-01-13 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 (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-20110009426-A1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS UTS2R, PLAUR, NTSR2 PAICS 146/4885FFAR1 271/4885FFAR4 302/4885
US-20130252974-A1 5,6-BISARYL-2-PYRIDINE-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AS UROTENSIN II RECEPTOR ANTAGONISTS UTS2R, PLAUR, NTSR2 PAICS 146/4885FFAR1 271/4885FFAR4 302/4885

“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.