SCHEMBL6917036

SCHEMBL6917036

CC(C)(C)OC(=O)N1CCCC1CCc1ccc(N)cc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.44
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
CHEK2 O96017 1/20 0.43
PDE8B O95263 1/20 0.42
NPC1 O15118 1/20 0.42
OPRD1 P41143 1/20 0.41
NR1H2 P55055 1/20 0.41
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FPR3 P25089 1/20 0.40
FPR2 P25090 1/20 0.40

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
SCHEMBL2689602 0.88 KLK7 (0.49) NPC1OPRD1NR1H2
SCHEMBL13086596 0.88 KLK7 (0.49) NPC1OPRD1NR1H2
SCHEMBL3046705 0.88 KLK7 (0.49) NPC1OPRD1NR1H2
SCHEMBL23116888 0.86 ATM (0.46) ATMCHEK2PDE8B
SCHEMBL21357556 0.86 ATM (0.46) ATMCHEK2PDE8B
SCHEMBL22652855 0.82 ATM (0.45) ATMCHEK2PDE8B
SCHEMBL6195438 0.81 ALOX5AP (0.52) ALOX5APFEN1CHEK2
SCHEMBL6182367 0.81 ALOX5AP (0.52) ALOX5APFEN1CHEK2
SCHEMBL13086758 0.81 MEN1 (0.50) NPC1OPRD1
SCHEMBL28334115 0.80 NR1H2 (0.44) ATMPDE8BNPC1NR1H2

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 12 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
US-11697636-B2 Substituted benzamides HOFFMANN-LA ROCHE INC. (US) 2023-07-11 US 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-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
US-20160264596-A1 SUBSTITUTED BENZAMIDES HOFFMANN-LA ROCHE INC. 2016-09-15 US 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
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 ATM 2142/4885ALOX5AP 3284/4885FEN1 4697/4885
US-20210061760-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R ATM 2142/4885ALOX5AP 3284/4885FEN1 4697/4885
US-20110152245-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R ATM 2142/4885ALOX5AP 3284/4885FEN1 4697/4885
US-20200048194-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R ATM 2142/4885ALOX5AP 3284/4885FEN1 4697/4885
US-11697636-B2 Substituted benzamides TAAR1, TAAR5, NPY1R ATM 2142/4885ALOX5AP 3284/4885FEN1 4697/4885

“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.