SCHEMBL732240

SCHEMBL732240

O=C(O)Cn1ncc2c1CCC[C@H]2NCS(=O)(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.40
PPARG P37231 4/20 0.36
PTGDR2 Q9Y5Y4 8/20 0.35
PTGDR Q13258 7/20 0.35
HIF1A Q16665 1/20 0.35
SCN9A Q15858 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
KMO O15229 1/20 0.32

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
SCHEMBL734510 0.93 HIF1A (0.36) FFAR1PTGDR2HIF1ASCN9AKDM4C
SCHEMBL733668 0.92 EGLN1 (0.35) FFAR1PPARGPTGDR2KMO
SCHEMBL732248 0.92 KDM4C (0.40) PTGDR2HIF1ASCN9AKDM4C
SCHEMBL731648 0.88 FFAR1 (0.39) FFAR1PTGDR2PTGDRSCN9A
SCHEMBL732529 0.88 FFAR1 (0.37) FFAR1PTGDR2PTGDRSCN9AKMO
SCHEMBL734190 0.87 SOS1 (0.39) FFAR1SCN9A
SCHEMBL732336 0.86 FFAR1 (0.35) FFAR1PTGDR2KDM4C
SCHEMBL733796 0.84 PREP (0.36) FFAR1KDM4C
SCHEMBL731745 0.84 SCN9A (0.35) FFAR1SCN9AKDM4C
SCHEMBL734027 0.83 FFAR1 (0.35) FFAR1PTGDR2SCN9AKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2307383-B1 AMINOTETRAHYDROINDAZOLOACETIC ACIDS HOFFMANN LA ROCHE (CH) 2012-05-16 EP claimed
US-8138208-B2 Aminotetrahydroindazoloacetic acids HOFFMANN-LA ROCHE INC. (US) 2012-03-20 US claimed
US-20100016369-A1 AMINOTETRAHYDROINDAZOLOACETIC ACIDS CHEN LI 2010-01-21 US claimed
US-8420675-B2 Aminotetrahydroindazoloacetic acids HOFFMANN-LA ROCHE INC. (US) 2013-04-16 US disclosed
EP-2307383-B1 AMINOTETRAHYDROINDAZOLOACETIC ACIDS HOFFMANN LA ROCHE (CH) 2012-05-16 EP disclosed
US-20120101131-A1 Aminotetrahydroindazoloacetic Acids CHEN LI (CN) 2012-04-26 US disclosed
US-8138208-B2 Aminotetrahydroindazoloacetic acids HOFFMANN-LA ROCHE INC. (US) 2012-03-20 US disclosed
US-20100016369-A1 AMINOTETRAHYDROINDAZOLOACETIC ACIDS CHEN LI 2010-01-21 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-20120101131-A1 Aminotetrahydroindazoloacetic Acids HRH2, HRH1, HRH4 FFAR1 43/4885PPARG 966/4885PTGDR2 16/4885
US-20100016369-A1 AMINOTETRAHYDROINDAZOLOACETIC ACIDS HRH2, HRH1, HRH4 FFAR1 43/4885PPARG 966/4885PTGDR2 16/4885

“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.