SCHEMBL1468653

SCHEMBL1468653

CCCc1ccc(N2Cc3cc(N(C)C)ccc3C2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
PKM P14618 3/20 0.41
PARP1 P09874 1/20 0.40
MGLL Q99685 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2C P28335 3/20 0.37
HTR2A P28223 2/20 0.37
HTR2B P41595 1/20 0.37
GAA P10253 2/20 0.36
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL1470232 0.93 MLNR (0.41) NPC1RAB9APKMPARP1MGLL
SCHEMBL1468719 0.91 FAAH (0.43) NPC1RAB9APKMPARP1MGLL
SCHEMBL1468427 0.91 FAAH (0.43) NPC1RAB9APKMPARP1MGLL
SCHEMBL1468585 0.90 NPC1 (0.41) NPC1RAB9APKMPARP1MGLL
SCHEMBL1468463 0.84 RXRA (0.43) NPC1RAB9APKMPARP1ALDH1A1
SCHEMBL1468601 0.83 NPC1 (0.43) NPC1RAB9APKMMGLLALDH1A1
SCHEMBL1468193 0.82 CYP4Z1 (0.41) NPC1RAB9APKMPARP1HTR1A
SCHEMBL1468040 0.81 FAAH (0.43) NPC1RAB9APKMPARP1MGLL
SCHEMBL1467542 0.81 FAAH (0.43) NPC1RAB9APKMPARP1MGLL
SCHEMBL1467522 0.80 NPC1 (0.47) NPC1RAB9APKMPARP1MGLL

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-8722723-B2 Aromatic amide derivative RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2014-05-13 US disclosed
US-20110071304-A1 AROMATIC AMIDE DERIVATIVE RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-03-24 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-20110071304-A1 AROMATIC AMIDE DERIVATIVE NCOR2, NCOR1, EP300 NPC1 2827/4885RAB9A 1837/4885PKM 3633/4885

“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.