SCHEMBL3272128

SCHEMBL3272128

CCOc1ccc2c(c1)C(C)(c1ccccc1Cl)C(=O)N2S(=O)(=O)c1ccc(NC(=O)O)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 4/20 0.41
AVPR1B P47901 10/20 0.39
OXTR P30559 3/20 0.39
AVPR2 P30518 2/20 0.39
GPR65 Q8IYL9 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PAX8 Q06710 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL3230001 0.91 AVPR1A (0.39) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3231336 0.88 AVPR1B (0.48) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3231270 0.86 AVPR1B (0.41) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3237260 0.85 AVPR1A (0.56) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3228969 0.83 AVPR1B (0.40) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3231620 0.83 AVPR1B (0.40) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL7471788 0.82 POLB (0.43) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL7466977 0.81 AVPR1A (0.39) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL3231614 0.81 AVPR1B (0.40) AVPR1AAVPR1BOXTRAVPR2GPR65
SCHEMBL7470867 0.81 AVPR1B (0.40) AVPR1AAVPR1BOXTRAVPR2GPR65

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
EP-2097374-B1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS SANOFI AVENTIS (FR) 2010-06-09 EP disclosed
EP-1473297-B1 PROCESS FOR PRODUCING TERTIARY PHOSPHINE HAVING BULKY HYDROCARBON GROUP BONDED HOKKO CHEM IND CO (JP) 2009-10-14 EP disclosed
EP-2097374-A2 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS Sanofi-Aventis (FR) 2009-09-09 EP disclosed
WO-2008087278-A2 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS SANOFI-AVENTIS (FR) 2008-07-24 WO disclosed
US-7250535-B2 Process for producing tertiary phosphine HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 2007-07-31 US disclosed
US-20060020148-A1 Process for producing tertiary phosphine having bulky hydrocarbon group bonded HOLLO CHEMICAL INDUSTRY CO., LTD (JP) 2006-01-26 US disclosed
EP-1473297-A1 PROCESS FOR PRODUCING TERTIARY PHOSPHINE HAVING BULKY HYDROCARBON GROUP BONDED HOKKO CHEMICAL INDUSTRY CO. LTD. (JP) 2004-11-03 EP 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-20060020148-A1 Process for producing tertiary phosphine having bulky hydrocarbon group bonded HRH3, HRH4, HRH1 AVPR1A 4068/4885AVPR1B 4206/4885OXTR 4361/4885

“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.