SCHEMBL1990925

SCHEMBL1990925

CC(C)(C)OC(=O)N1CCC(Oc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TP53 P04637 1/20 0.53
MAPT P10636 1/20 0.53
THRB P10828 1/20 0.53
NR3C1 P04150 2/20 0.49
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
PTPN6 P29350 1/20 0.47
USP30 Q70CQ3 1/20 0.47
GPR119 Q8TDV5 2/20 0.47
ABL1 P00519 1/20 0.47
RIN1 Q13671 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
PIK3CD O00329 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL1990928 1.00 NPC1 (0.55) NPC1RAB9AMEN1KMT2ATP53
SCHEMBL17542185 0.92 MEN1 (0.60) NPC1RAB9AMEN1KMT2ATP53
SCHEMBL21436867 0.88 GPR119 (0.57) MEN1KMT2AUSP30GPR119PIK3CD
SCHEMBL4312281 0.85 GPR119 (0.54) MEN1KMT2AUSP30GPR119PIK3CD
SCHEMBL4312286 0.85 GPR119 (0.54) MEN1KMT2AUSP30GPR119PIK3CD
SCHEMBL502898 0.84 TP53 (0.59) NPC1RAB9AMEN1KMT2ATP53
SCHEMBL502899 0.84 TP53 (0.59) NPC1RAB9AMEN1KMT2ATP53
SCHEMBL5548078 0.82 GPR119 (0.55) KMT2AUSP30GPR119PIK3CDALDH1A1
SCHEMBL28716248 0.82 GPR119 (0.55) KMT2AUSP30GPR119PIK3CDALDH1A1
SCHEMBL5548878 0.82 GPR119 (0.55) KMT2AUSP30GPR119PIK3CDALDH1A1

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
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
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 NPC1 937/4885RAB9A 1592/4885MEN1 1920/4885
US-20210061760-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R NPC1 937/4885RAB9A 1592/4885MEN1 1920/4885
US-20110152245-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R NPC1 937/4885RAB9A 1592/4885MEN1 1920/4885
US-20200048194-A1 SUBSTITUTED BENZAMIDES TAAR1, TAAR5, NPY1R NPC1 937/4885RAB9A 1592/4885MEN1 1920/4885
US-11697636-B2 Substituted benzamides TAAR1, TAAR5, NPY1R NPC1 937/4885RAB9A 1592/4885MEN1 1920/4885

“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.