SCHEMBL16893571

SCHEMBL16893571

CCc1cc(OC(F)(F)F)cc2c1O[C@H](C(F)(F)F)C(C(=O)Cl)=C2

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.81
PTGS1 P23219 16/20 0.81

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
SCHEMBL16893575 1.00 PTGS2 (0.81) PTGS2PTGS1
SCHEMBL5172024 0.89 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5172247 0.89 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5172023 0.89 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5171215 0.89 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL27628490 0.88 PTGS2 (0.98) PTGS2PTGS1
SCHEMBL27628489 0.88 PTGS2 (0.98) PTGS2PTGS1
SCHEMBL27628390 0.88 PTGS2 (0.98) PTGS2PTGS1
SCHEMBL16893895 0.88 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL16893898 0.88 PTGS2 (0.76) 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
EP-3094333-B1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2020-10-14 EP disclosed
EP-3094333-B1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2020-10-14 EP disclosed
US-10266511-B2 No-releasing nitrooxy-chromene conjugates Euclises Pharmaceuticals, Inc. (US) 2019-04-23 US disclosed
US-10266511-B2 No-releasing nitrooxy-chromene conjugates Euclises Pharmaceuticals, Inc. (US) 2019-04-23 US disclosed
US-20160340330-A1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES Euclises Pharmaceuticals, Inc. 2016-11-24 US disclosed
US-20160340330-A1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES Euclises Pharmaceuticals, Inc. 2016-11-24 US disclosed
WO-2015109011-A1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES Euclises Pharmaceuticals, Inc. (US) 2015-07-23 WO disclosed
US-20150197500-A1 NO-RELEASING GUANIDINE-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2015-07-16 US disclosed
US-20150197500-A1 NO-RELEASING GUANIDINE-CHROMENE CONJUGATES EUCLISES PHARMACEUTICALS INC (US) 2015-07-16 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 (3 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-20150197500-A1 NO-RELEASING GUANIDINE-CHROMENE CONJUGATES ARG1, ARGLU1, CGAS PTGS2 1336/4885PTGS1 901/4885
US-10266511-B2 No-releasing nitrooxy-chromene conjugates NOS1, NOS2, NOS3 PTGS2 608/4885PTGS1 209/4885
US-20160340330-A1 NO-RELEASING NITROOXY-CHROMENE CONJUGATES NOS1, NOS2, NOS3 PTGS2 608/4885PTGS1 209/4885

“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.