SCHEMBL4099165

SCHEMBL4099165

CCCCCNc1nc(C)cs1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.59
NPC1 O15118 5/20 0.59
MAPT P10636 4/20 0.59
ALDH1A1 P00352 3/20 0.59
STAT1 P42224 1/20 0.59
GAA P10253 3/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 1/20 0.42
DNM2 P50570 5/20 0.42
MMP3 P08254 1/20 0.41
MEN1 O00255 1/20 0.40
NPY5R Q15761 2/20 0.39
TYR P14679 1/20 0.39
FDPS P14324 1/20 0.39
TLR8 Q9NR97 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL24590345 0.98 RAB9A (0.57) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL12597147 0.87 RAB9A (0.54) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL11934938 0.83 RAB9A (0.47) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL28154659 0.79 NPC1 (0.56) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL8302977 0.79
SCHEMBL9836855 0.78 NPC1 (0.55) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL15286383 0.78 RAB9A (0.53) RAB9ANPC1MAPTALDH1A1GAA
SCHEMBL1205189 0.78 NPC1 (0.65) RAB9ANPC1MAPTALDH1A1STAT1
SCHEMBL10466181 0.77 NPC1 (0.54) RAB9ANPC1MAPTALDH1A1STAT1
Hydrochloric Acid SCHEMBL15286474 0.76 RAB9A (0.51) RAB9ANPC1MAPTALDH1A1GAA

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 3 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
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 RAB9A 3630/4885NPC1 4539/4885MAPT 1644/4885

“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.