SCHEMBL5932405

SCHEMBL5932405

CCCCOC(CCC)OC([O])=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
ATM Q13315 1/20 0.35
TSHR P16473 4/20 0.33
HPGD P15428 1/20 0.33
CTSK P43235 1/20 0.33
LMNA P02545 4/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
ESR1 P03372 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPK1 P28482 1/20 0.33
NR1H2 P55055 1/20 0.33
RNASEL Q05823 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL5932388 0.93 NAAA (0.40) TSHRLMNA
SCHEMBL5487103 0.86 ALDH1A1 (0.39) ALDH1A1ATMTSHRHPGDCTSK
SCHEMBL3023337 0.85 ALDH1A1 (0.47) ALDH1A1ATMTSHRHPGDCTSK
SCHEMBL5487107 0.85 ALDH1A1 (0.38) ALDH1A1ATMTSHRHPGDMAPK1
SCHEMBL1470030 0.83 CA1 (0.39) ALDH1A1ATMTSHRHPGDCTSK
SCHEMBL5932618 0.83 ALDH1A1 (0.36) ALDH1A1ATMTSHRHPGDCTSK
SCHEMBL20293872 0.83 NAAA (0.41) ALDH1A1ATMLMNA
SCHEMBL11384726 0.82 CHRM1 (0.34) TSHRTAS1R3TAS1R1CYP3A4
SCHEMBL1469672 0.81 ALDH1A1 (0.44) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL23161035 0.80 TSHR (0.36) ALDH1A1ATMTSHRHPGDCTSK

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 2071/4885ATM 1855/4885TSHR 1237/4885

“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.