SCHEMBL9640232

SCHEMBL9640232

CCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
TSHR P16473 2/20 0.65
THRB P10828 1/20 0.64
HTT P42858 1/20 0.64
MAPT P10636 1/20 0.64
MAPK1 P28482 2/20 0.62
ALDH1A1 P00352 3/20 0.58
HSD17B10 Q99714 1/20 0.42
USP2 O75604 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
CASP1 P29466 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
SLCO1B1 Q9Y6L6 1/20 0.40
TDP1 Q9NUW8 1/20 0.34
APP P05067 3/20 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
SCHEMBL55777 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL12253189 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL6692098 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL12595172 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL11913572 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL9639261 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
Triethylene Glycol SCHEMBL55776 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL9639239 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL19000744 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT
SCHEMBL14495475 1.00 MEN1 (0.69) MEN1KMT2ATSHRTHRBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114025736-A Topical scalp care compositions 宝洁公司 2022-02-08 CN disclosed
US-9815790-B2 Chemically modified quinoline and quinolone derivatives useful as CB-1 inverse agonists JANSSEN PHARMACEUTICA NV (BE) 2017-11-14 US disclosed
US-20170179362-A1 THERMOELECTRIC CONVERSION ELEMENT, n-TYPE THERMOELECTRIC CONVERSION LAYER, AND COMPOSITION FOR FORMING n-TYPE THERMOELECTRIC CONVERSION LAYER FUJIFILM CORPORATION (JP) 2017-06-22 US disclosed
US-20170057922-A1 CHEMICALLY MODIFIED QUINOLINE AND QUINOLONE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2017-03-02 US disclosed
US-5120459-A Functional fluids MONSANTO COMPANY (US) 1992-06-09 US disclosed
US-5076949-A Novel perfluorinated polyethers and process for their preparation MONSANTO COMPANY (US) 1991-12-31 US disclosed
US-4996369-A Perfluoroheptaglyme dimer; lubricants; heat exchangers; vacuum pump oils MONSANTO COMPANY (US) 1991-02-26 US disclosed
US-4871109-A PERFLUOROHEPTAGLYME; NONTOXIC MONSANTO COMPANY (US) 1989-10-03 US disclosed
EP-0332601-A1 Novel perfluorinated polyethers and process for their preparation Monsanto Company (US) 1989-09-13 EP disclosed
EP-0326539-A1 Vapor phase soldering using certain perfluorinated polyethers Monsanto Company (US) 1989-08-02 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-20170057922-A1 CHEMICALLY MODIFIED QUINOLINE AND QUINOLONE DERIVATIVES USEFUL AS CB-1 INVERSE AGONISTS CNR1, CNR2, OPRK1 MEN1 2202/4885KMT2A 1959/4885TSHR 530/4885

“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.