SCHEMBL8930848

SCHEMBL8930848

CCCCCCCCCCCC(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.48
OPRM1 P35372 1/20 0.46
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 2/20 0.42
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
SPHK1 Q9NYA1 1/20 0.38
FFAR1 O14842 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.38

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
SCHEMBL28326222 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL3506724 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL113618 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL3506995 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL3506094 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL6666312 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL7549190 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL872866 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL21484061 1.00 SMPD1 (0.48) SMPD1OPRM1LMNATSHRTHRB
SCHEMBL3380382 0.97 OPRM1 (0.48) SMPD1OPRM1LMNATSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112034072-B Method for measuring content and condensation degree of citral diethyl acetal and laural diethyl acetal in perfume by gas chromatography-tandem mass spectrometry 河南牧业经济学院 2023-05-12 CN claimed
JP-9003087-A None JP disclosed
CN-103012628-A Solid catalyst for olefin polymerization and process for producing olefin polymer SUMITOMO CHEMICAL CO 2013-04-03 CN disclosed
US-20130072648-A1 SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-21 US disclosed
US-8329957-B2 Synthetic navel orangeworm pheromone composition and methods relating to production of same SUTERRA LLC (US) 2012-12-11 US disclosed
US-20120142972-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME SUTERRA LLC 2012-06-07 US disclosed
US-8115035-B2 Synthetic navel orangeworm pheromone composition and methods relating to production of same SUTERRA, LLC (US) 2012-02-14 US disclosed
US-20110098508-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME SUTERRA LLC 2011-04-28 US disclosed
US-7737306-B2 Synthetic navel orangeworm pheromone composition and methods relating to production of same SUTERRA, LLC (US) 2010-06-15 US disclosed
US-20100099920-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME SUTERRA LLC 2010-04-22 US disclosed
JP-H093087-A TREHALOSE DERIVATIVE AND SURFACTANT KANEBO LTD 1997-01-07 JP 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 (3 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-20100099920-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME ERG28, BMP1, OR10J3 SMPD1 402/4885OPRM1 1041/4885LMNA 2447/4885
US-20120142972-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME ERG28, BMP1, OR10J3 SMPD1 402/4885OPRM1 1041/4885LMNA 2447/4885
US-20110098508-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME ERG28, BMP1, OR10J3 SMPD1 402/4885OPRM1 1041/4885LMNA 2447/4885

“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.