SCHEMBL5169263

SCHEMBL5169263

CCOC(=O)C1=Cc2cc(C)cc(C)c2O[C@@H]1C(F)(F)F

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.70
PTGS1 P23219 12/20 0.70

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
SCHEMBL5170006 1.00 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL5169272 1.00 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL16707205 0.93 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL22540834 0.90 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL20921387 0.90 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL16893798 0.90 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL16893796 0.90 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL16893900 0.90 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL16893903 0.90 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL16550697 0.90 PTGS2 (0.71) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10266511-B2 No-releasing nitrooxy-chromene conjugates Euclises Pharmaceuticals, Inc. (US) 2019-04-23 US disclosed
EP-1778662-A1 PHOTORACEMIZATION OF 2-TRIFLUOROMETHYL-2H-CHROMENE-3-CARBOXYLIC ACID DERIVATIVES Warner-Lambert Company LLC (US) 2007-05-02 EP disclosed
EP-1773802-A1 ENANTIOSELECTIVE METHOD FOR SEPARING SUBSTITUTED 2-TRIFLUOROMETHYL-2H-CHROMENE-3-CARBOXYLIC ACID DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2007-04-18 EP disclosed
WO-2006011045-A1 PHOTORACEMIZATION OF 2-TRIFLUOROMETHYL-2H-CHROMENE-3-CARBOXYLIC ACID DERIVATIVES WARNER-LAMBERT COMPANY LLC (US) 2006-02-02 WO disclosed
WO-2006011047-A1 ENANTIOSELECTIVE METHOD FOR SEPARING SUBSTITUTED 2-TRIFLUOROMETHYL-2H-CHROMENE-3-CARBOXYLIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-02 WO disclosed
WO-2006011052-A1 METHOD FOR THE RACEMIZATION OF 2-TRIFLUORO-2H-CHROMENE-3-CARBOXYLIC ACIDS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-02 WO disclosed
US-20060020023-A1 Racemization method PHARMACIA & UPJOHN COMPANY LLC 2006-01-26 US disclosed
US-20060016683-A1 Photoracamization method PHARMACIA & UPJOHN COMPANY LLC 2006-01-26 US disclosed
US-20060020022-A1 Enantioselective separation method PHARMACIA & UPJOHN COMPANY LLC 2006-01-26 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 (4 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-10266511-B2 No-releasing nitrooxy-chromene conjugates NOS1, NOS2, NOS3 PTGS2 608/4885PTGS1 209/4885
US-20060020023-A1 Racemization method STS, SQLE, HAO2 PTGS2 1102/4885PTGS1 1630/4885
US-20060016683-A1 Photoracamization method CYP3A43, CRY2, CRY1 PTGS2 728/4885PTGS1 1526/4885
US-20060020022-A1 Enantioselective separation method SLC7A1, SLC10A1, DHCR7 PTGS2 3281/4885PTGS1 4145/4885

“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.