SCHEMBL21581256

SCHEMBL21581256

CCCCCCCCCCCCCCOBO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.44
LPAR3 Q9UBY5 6/20 0.43
LPAR2 Q9HBW0 5/20 0.43
LPAR1 Q92633 2/20 0.43
NAAA Q02083 1/20 0.43
TSHR P16473 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CES2 O00748 1/20 0.41
GBA1 P04062 1/20 0.41
EPHX1 P07099 1/20 0.40
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL1473434 1.00 THRB (0.44) THRBMEN1KMT2AHTTMAPT
SCHEMBL15092019 1.00
SCHEMBL21581249 1.00 THRB (0.44) THRBMEN1KMT2AHTTMAPT
SCHEMBL17937906 1.00 THRB (0.44) THRBMEN1KMT2AHTTMAPT
SCHEMBL21581268 1.00 THRB (0.44) THRBMEN1KMT2AHTTMAPT
SCHEMBL45784 0.97
Alcohol SCHEMBL28159426 0.84 TSHR (0.44) THRBMEN1KMT2AHTTMAPT
Acetonitrile SCHEMBL28980702 0.78 TSHR (0.34) TSHRALDH1A1
SCHEMBL21581247 0.78 THRB (0.47) THRBMEN1KMT2AHTTMAPT
SCHEMBL14688826 0.78 THRB (0.47) THRBMEN1KMT2AHTTMAPT

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
EP-3575289-B1 ALKANOLAMINE, FRICTION-REDUCING AGENT, AND LUBRICATING OIL COMPOSITION TOSOH CORP (JP) 2023-04-19 EP disclosed
US-10927084-B2 Alkanolamine, friction-reducing agent, and lubricating oil composition TOSOH CORPORATION (JP) 2021-02-23 US disclosed
US-20200039942-A1 ALKANOLAMINE, FRICTION-REDUCING AGENT, AND LUBRICATING OIL COMPOSITION TOSOH CORPORATION (JP) 2020-02-06 US disclosed
EP-3575289-A1 ALKANOLAMINE, FRICTION-REDUCING AGENT, AND LUBRICATING OIL COMPOSITION Tosoh Corporation (JP) 2019-12-04 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 (2 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-20200039942-A1 ALKANOLAMINE, FRICTION-REDUCING AGENT, AND LUBRICATING OIL COMPOSITION APOB, HRH3, PHOSPHO1 THRB 1854/4885MEN1 3143/4885KMT2A 1714/4885
US-10927084-B2 Alkanolamine, friction-reducing agent, and lubricating oil composition APOB, HRH3, PHOSPHO1 THRB 1854/4885MEN1 3143/4885KMT2A 1714/4885

“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.