SCHEMBL6897138

SCHEMBL6897138

CCCCCCC(C)[CH]O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.46
LMNA P02545 1/20 0.46
OPRM1 P35372 1/20 0.44
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
ADH7 P40394 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
FDPS P14324 3/20 0.41
FFAR1 O14842 1/20 0.41
CA1 P00915 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 1/20 0.40
DNM1 Q05193 1/20 0.40

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
SCHEMBL6901425 0.97
SCHEMBL6082623 0.90
SCHEMBL28808054 0.81 ACE2 (0.44) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4275310 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4272101 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4269729 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4276686 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4281820 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4275203 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C
SCHEMBL4275505 0.79 OPRM1 (0.48) SPHK1LMNAOPRM1ADH1BADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833481-B2 Catalytic dehydrative isomerization TAKASAGO INTERNATIONAL CORPORATION (JP) 2004-12-21 US disclosed
US-20030109755-A1 Process for producing 2-alkyl-2cyclopentenones TAKASAGO INTERNATIONAL CORPORATION 2003-06-12 US disclosed
EP-1316541-A1 Process for producing 2-alkyl-2-cyclopentenones Takasago International Corporation (JP) 2003-06-04 EP disclosed
CN-1421429-A Process for producing 2-alkyl-2-cyclopentenone TAKASAGO PERFUMERY CO LTD (JP) 2003-06-04 CN 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-20030109755-A1 Process for producing 2-alkyl-2cyclopentenones HSD3B2, DHPS, HSD3B1 SPHK1 349/4885LMNA 3783/4885OPRM1 3022/4885

“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.