SCHEMBL4916259

SCHEMBL4916259

CCCCOC(=O)C1CCCCN1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.47
TLR2 O60603 2/20 0.42
DPP7 Q9UHL4 1/20 0.42
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.38
HPGD P15428 1/20 0.36
TSHR P16473 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
SCHEMBL14794763 1.00 PRCP (0.47) PRCPTLR2DPP7ALDH1A1ATM
SCHEMBL23485244 0.98 PRCP (0.46) PRCPTLR2DPP7ALDH1A1ATM
SCHEMBL18903201 0.98 PRCP (0.46) PRCPTLR2DPP7ALDH1A1ATM
SCHEMBL7293853 0.95 PRCP (0.49) PRCPTLR2DPP7
SCHEMBL8257937 0.95 PRCP (0.51) PRCPTLR2DPP7ALDH1A1ATM
SCHEMBL2638667 0.95 PRCP (0.51) PRCPTLR2DPP7ALDH1A1ATM
SCHEMBL2713588 0.95 PRCP (0.51) PRCPTLR2DPP7ALDH1A1ATM
Hydrochloric Acid SCHEMBL8661704 0.94 TLR2 (0.48) PRCPTLR2DPP7
SCHEMBL7296427 0.94 PRCP (0.51) PRCPTLR2DPP7TSHR
Hydrochloric Acid SCHEMBL7366846 0.94 PRCP (0.50) PRCPTLR2DPP7ALDH1A1ATM

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
US-20080064723-A1 Aminocyclohexane carboxylic acid and its esters, aminocyclohexane derivatives such as aminocyclohexanol, and piperidinecarboxylic acid and its esters, hydroxypiperidine ; applied to human scalp SHISEIDO COMPANY, LTD. (JP) 2008-03-13 US disclosed
CN-101039649-A Anti-graying preparation SHISEIDO CO LTD (JP) 2007-09-19 CN disclosed
EP-1806121-A1 ANTI-GRAYING PREPARATION Shiseido Company, Limited (JP) 2007-07-11 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-20080064723-A1 Aminocyclohexane carboxylic acid and its esters, aminocyclohexane derivatives such as aminocyclohexanol, and piperidinecarboxylic acid and its esters, hydroxypiperidine ; applied to human scalp HCAR1, HCAR3, DDC PRCP 2595/4885TLR2 4496/4885DPP7 2936/4885

“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.