SCHEMBL20587384

SCHEMBL20587384

Cc1c(C(N)=O)cccc1N1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.71
HTT P42858 2/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 3/20 0.50
KDM4E B2RXH2 1/20 0.50
THRB P10828 1/20 0.50
ALOX15 P16050 1/20 0.50
GFER P55789 1/20 0.50
YWHAG P61981 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
ATM Q13315 2/20 0.49
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PARP1 P09874 1/20 0.45
NPSR1 Q6W5P4 3/20 0.45
TSHR P16473 2/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL28793930 0.95 NPC1 (0.63) NPC1HTTMEN1KMT2ALMNA
Pyrrole SCHEMBL28237296 0.92 NPC1 (0.60) NPC1HTTMEN1KMT2ALMNA
SCHEMBL3436295 0.86 NPC1 (0.51) NPC1MEN1KMT2ALMNAMAPT
SCHEMBL6105727 0.85 NPC1 (0.54) NPC1HTTMEN1KMT2ALMNA
SCHEMBL2612163 0.85 NPC1 (0.54) NPC1HTTMEN1KMT2ALMNA
SCHEMBL1742844 0.84 ADRB1 (0.59) NPC1HSD17B10TSHR
SCHEMBL5532619 0.83 NPC1 (0.51) NPC1MEN1KMT2ALMNAMAPT
SCHEMBL605593 0.83 NPC1 (1.00) NPC1HTTMEN1KMT2AMAPT
SCHEMBL3083169 0.83 NPC1 (1.00) NPC1HTTMEN1KMT2AMAPT
SCHEMBL2505914 0.82 NPC1 (0.73) NPC1HTTMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11203582-B2 Benzamide derivatives for inhibiting endoplasmic reticulum (ER) stress THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2021-12-21 US disclosed
US-20200199094-A1 BENZAMIDE DERIVATIVES FOR INHIBITING ENDOPLASMIC RETICULUM (ER) STRESS THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA 2020-06-25 US disclosed
WO-2018232264-A1 BENZAMIDE DERIVATIVES FOR INHIBITING ENDOPLASMIC RETICULUM (ER) STRESS THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2018-12-20 WO disclosed
CN-107835806-A The catalytic hydrogenation of substituted cyanopyridine and the method for preparing the pyridylmethyl benzamide substituted 拜耳作物科学股份公司 2018-03-23 CN disclosed
CN-1449493-A Aminophenoxyacetamide derivatives and pharmaceutical compositions containing them SUNTORY LTD (JP) 2003-10-15 CN 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-20200199094-A1 BENZAMIDE DERIVATIVES FOR INHIBITING ENDOPLASMIC RETICULUM (ER) STRESS HSPA5, TMBIM6, BAD NPC1 2297/4885HTT 3558/4885MEN1 4714/4885
US-11203582-B2 Benzamide derivatives for inhibiting endoplasmic reticulum (ER) stress HSPA5, TMBIM6, BAD NPC1 2297/4885HTT 3558/4885MEN1 4714/4885

“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.