SCHEMBL912865

SCHEMBL912865

CCOc1ccc(C)c(-c2ccc(C(=O)N[C@]3(C(=O)OC)CC[C@@H](O)CC3)nc2-c2ccc(Cl)c(OCCCN(C)C)c2)c1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PAICS P22234 4/20 0.33
UTS2R Q9UKP6 3/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
SENP2 Q9HC62 1/20 0.31
SENP1 Q9P0U3 1/20 0.31
ROCK2 O75116 1/20 0.31
KDR P35968 2/20 0.31
AGER Q15109 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
HSP90AB1 P08238 1/20 0.31
NAMPT P43490 1/20 0.30
PRKD3 O94806 1/20 0.30
PRKD1 Q15139 1/20 0.30
PRKD2 Q9BZL6 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
SCHEMBL912866 1.00 PAICS (0.33) PAICSUTS2RFFAR1FFAR4SENP2
SCHEMBL912863 1.00 PAICS (0.33) PAICSUTS2RFFAR1FFAR4SENP2
SCHEMBL2489565 0.95 PAICS (0.35) PAICSUTS2RFFAR1FFAR4ROCK2
SCHEMBL2489569 0.95 PAICS (0.35) PAICSUTS2RFFAR1FFAR4ROCK2
SCHEMBL2489570 0.95 PAICS (0.35) PAICSUTS2RFFAR1FFAR4ROCK2
SCHEMBL914760 0.93 PAICS (0.33) PAICSUTS2RFFAR1FFAR4SENP2
SCHEMBL913824 0.90 ATM (0.34) PAICSKDR
SCHEMBL913821 0.90 ATM (0.34) PAICSKDR
SCHEMBL913823 0.90 ATM (0.34) PAICSKDR
Hydrochloric Acid SCHEMBL913472 0.89 ATM (0.33) PAICSKDR

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 146/4885UTS2R 1/4885FFAR1 271/4885
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 146/4885UTS2R 1/4885FFAR1 271/4885

“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.