SCHEMBL4110458

SCHEMBL4110458

CCC(=O)N(C)c1cc(C)on1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
ALDH1A1 P00352 3/20 0.39
GAA P10253 3/20 0.39
EGFR P00533 1/20 0.39
SMN1; SMN2 Q16637 6/20 0.38
MAPT P10636 5/20 0.38
TP53 P04637 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
CYP2C19 P33261 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HTT P42858 1/20 0.37
MAPK1 P28482 1/20 0.36
S1PR3 Q99500 1/20 0.36

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
SCHEMBL10807240 0.83 NPC1 (0.48) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL4102599 0.80 MAPT (0.41) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL4104930 0.79 EGFR (0.43) NPC1RAB9AALDH1A1EGFRSMN1; SMN2
SCHEMBL11644997 0.79 POLB (0.41) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL11642349 0.76 MAPT (0.41) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL19987474 0.76 RAB9A (0.39) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL27673428 0.73 MAPT (0.33) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL2174281 0.72 PKM (0.36) NPC1RAB9AALDH1A1GAAEGFR
SCHEMBL16828453 0.71
SCHEMBL18275043 0.70 CYP3A4 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2484342-A1 Hair resiliency / body improver and hair cosmetic Shiseido Company, Limited (JP) 2012-08-08 EP disclosed
CN-101953755-B Hair springiness and stiffness improving agent and hair cosmetic SHISEIDO CO LTD 2012-03-28 CN disclosed
US-20090233975-A1 Hair resiliency/body improver and hair cosmetic SHISEIDO COMPANY, LTD. (JP) 2009-09-17 US disclosed
EP-1911750-A1 AGENT FOR IMPROVEMENT IN BOUNCE/BODY OF HAIR, AND HAIR COSMETIC Shiseido Company, Limited (JP) 2008-04-16 EP 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-20090233975-A1 Hair resiliency/body improver and hair cosmetic MC1R, PNISR, HCRTR1 NPC1 4539/4885RAB9A 3630/4885ALDH1A1 291/4885

“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.