SCHEMBL17131603

SCHEMBL17131603

CCOC(=O)C1CCC(C)C(C)C1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ ALDH1A1 P00352 5/20 0.42
▸ PPM1B O75688 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ PPP1CC P36873 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL16134086 1.00 MAPT (0.45) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL31009727 1.00 MAPT (0.45) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL1169394 0.86 MAPT (0.52) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL12035330 0.85 MAPT (0.42) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL16134085 0.85 MAPT (0.42) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL1196227 0.85 MAPT (0.42) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL17131599 0.85 PPM1B (0.45) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL31009744 0.85 PPM1B (0.45) MAPTALDH1A1PPM1BPTPN1PPP1CC
SCHEMBL16134088 0.84 MAPT (0.41) MAPTALDH1A1MEN1KMT2ACYP3A4
SCHEMBL16674652 0.84 MAPT (0.41) MAPTALDH1A1PPM1BPTPN1PPP1CC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3521409-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2019-08-07 — — EP disclosed
EP-3122847-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2019-05-15 — — EP disclosed
US-20160289593-A1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2016-10-06 — — US disclosed
US-20160289593-A1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2016-10-06 — — US disclosed
US-20150275132-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2015-10-01 — — 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 (2 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-20160289593-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 MAPT 1867/4885ALDH1A1 1292/4885PPM1B 4095/4885
US-20150275132-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 MAPT 1867/4885ALDH1A1 1292/4885PPM1B 4095/4885

“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.

Send feedback