SCHEMBL15946358

SCHEMBL15946358

CC(C)(C)NC(=O)c1ccc(NC(=O)c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.67
APBA1 Q02410 1/20 0.67
NPC1 O15118 7/20 0.66
RAB9A P51151 7/20 0.66
KMT2A Q03164 2/20 0.66
MEN1 O00255 1/20 0.66
KDM4E B2RXH2 1/20 0.66
POLB P06746 1/20 0.66
PTPN1 P18031 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
MAPT P10636 1/20 0.64
SIRT1 Q96EB6 1/20 0.61
FFAR1 O14842 1/20 0.60
LMNA P02545 2/20 0.59
KCNK9 Q9NPC2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
HTT P42858 1/20 0.58

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
SCHEMBL15946363 0.88 SIRT1 (0.64) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL408310 0.87 CYP2C9 (0.67) NPC1RAB9APOLBSMN1; SMN2LMNA
SCHEMBL13701743 0.87 HDAC1 (0.66) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL23139020 0.86 NPC1 (0.55) CACNA1BAPBA1NPC1RAB9AKMT2A
SCHEMBL21282783 0.86 HDAC3 (0.73) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL15946364 0.85 ALDH1A1 (0.63) NPC1RAB9AKMT2AMEN1POLB
Bromide SCHEMBL6851253 0.85 CYP2C9 (0.65) NPC1RAB9APOLBSMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL22076570 0.85 CYP2C9 (0.65) NPC1RAB9APOLBSMN1; SMN2LMNA
SCHEMBL29201540 0.85 CYP2C9 (0.65) NPC1RAB9APOLBSMN1; SMN2LMNA
Fluoride SCHEMBL2310518 0.85 CYP2C9 (0.65) NPC1RAB9APOLBSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464064-B2 HCV helicase inhibitors and methods of use thereof UNIVERSITY OF KANSAS (US) 2016-10-11 US disclosed
US-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof UWM RESEARCH FOUNDATION, INC. (US) 2014-08-14 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 (1 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-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof DHX15, DDX5, DHX35 CACNA1B 4627/4885APBA1 2340/4885NPC1 2518/4885

“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.