SCHEMBL5933320

SCHEMBL5933320

CCC(CNCC(CC)CC(C)C)CC(C)C

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.48
CYP3A4 P08684 1/20 0.48
KDM4E B2RXH2 1/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL26211290 0.95 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4ADH1BADH1C
SCHEMBL19880451 0.85 ALDH1A1 (0.41) ALDH1A1TSHRCYP3A4
SCHEMBL21983908 0.81 KISS1R (0.36) ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL13676843 0.80 ALDH1A1 (0.50) ALDH1A1TSHRCYP3A4KDM4EADH1B
SCHEMBL13252778 0.80 ANPEP (0.38) ALDH1A1TSHRCYP3A4ADH1BADH1C
SCHEMBL17298943 0.79 ALDH1A1 (0.30) ALDH1A1TSHRCYP3A4
SCHEMBL11299041 0.79 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4
SCHEMBL22096778 0.79 ALDH1A1 (0.40) ALDH1A1TSHRCYP3A4ADH1BADH1C
SCHEMBL597708 0.78
SCHEMBL277434 0.78 ALDH1A1 (0.60) ALDH1A1TSHRCYP3A4KDM4E

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-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus MITSUI CHEMICALS, INC. (JP) 2006-04-27 US disclosed
EP-1484191-A1 REWRITABLE OPTICAL INFORMATION RECORDING MEDIUM AND RECORDING/REPRODUCING METHOD, RECORDING/REPRODUCING DEVICE Sony Corporation (JP) 2004-12-08 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-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus ALPG, TRPC6, GNRHR ALDH1A1 2071/4885TSHR 1237/4885CYP3A4 3876/4885

“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.