SCHEMBL1992923

SCHEMBL1992923

OC(F)Cc1cccc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.51
TAAR1 Q96RJ0 4/20 0.48
IDO1 P14902 2/20 0.47
AGXT P21549 2/20 0.47
PPARG P37231 4/20 0.44
PPARA Q07869 3/20 0.44
MIF P14174 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MPO P05164 1/20 0.41
MDM2 Q00987 1/20 0.41

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
SCHEMBL6224951 0.85 SLC1A1 (0.53) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL4965957 0.83 SLC1A1 (0.51) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL23886297 0.83 TAAR1 (0.52) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL4426896 0.82 SLC1A1 (0.50) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL27959639 0.82 SLC1A1 (0.50) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL4422549 0.82 SLC1A1 (0.50) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL2427588 0.82 SLC1A1 (0.50) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL15066444 0.80 SLC1A1 (0.49) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL8499668 0.80 SLC1A1 (0.49) SLC1A1TAAR1IDO1AGXTPPARG
SCHEMBL10586409 0.80 SLC1A1 (0.49) SLC1A1TAAR1IDO1AGXTPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11697636-B2 Substituted benzamides HOFFMANN-LA ROCHE INC. (US) 2023-07-11 US disclosed
EP-3187490-B1 SUBSTITUTED BENZAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2022-04-06 EP disclosed
US-20210061760-A1 SUBSTITUTED BENZAMIDES HOFFMANN LA ROCHE (US) 2021-03-04 US disclosed
US-20200048194-A1 SUBSTITUTED BENZAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2020-02-13 US disclosed
EP-3187490-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2017-07-05 EP disclosed
US-9452980-B2 Substituted benzamides HOFFMANN-LA ROCHE INC. (US) 2016-09-27 US disclosed
US-20160264596-A1 SUBSTITUTED BENZAMIDES HOFFMANN-LA ROCHE INC. 2016-09-15 US disclosed
EP-2516392-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-10-31 EP disclosed
WO-2011076678-A1 SUBSTITUTED BENZAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-30 WO disclosed
US-20110152245-A1 SUBSTITUTED BENZAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 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 (5 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-20160264596-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R SLC1A1 87/4885TAAR1 1/4885IDO1 554/4885
US-20210061760-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R SLC1A1 87/4885TAAR1 1/4885IDO1 554/4885
US-20110152245-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R SLC1A1 87/4885TAAR1 1/4885IDO1 554/4885
US-20200048194-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R SLC1A1 87/4885TAAR1 1/4885IDO1 554/4885
US-11697636-B2 Substituted benzamides TAAR1, TAAR5, NPY1R SLC1A1 87/4885TAAR1 1/4885IDO1 554/4885

“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.