SCHEMBL21581269

SCHEMBL21581269

CCCCCCCCCCCCCCCCCCCCCCCCN1CCNCC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GNAO1 P09471 9/20 0.65
▸ GNAI3 P08754 8/20 0.65
▸ GNAI1 P63096 8/20 0.65
▸ CXCR4 P61073 2/20 0.61
▸ SOD3 P08294 2/20 0.54
▸ HRH2 P25021 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL5394694 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL7336599 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL3716714 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL8723279 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL10379383 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL21581281 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL21581298 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL21581259 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL21581257 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3
SCHEMBL162842 1.00 GNAO1 (0.65) GNAO1GNAI3GNAI1CXCR4SOD3

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 5 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
CN-110198932-B Alkanolamine, friction reducer, and lubricating oil composition 东曹株式会社 2023-04-07 — — CN 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 GNAO1 2390/4885GNAI3 3257/4885GNAI1 2557/4885
US-10927084-B2 Alkanolamine, friction-reducing agent, and lubricating oil composition APOB, HRH3, PHOSPHO1 GNAO1 2390/4885GNAI3 3257/4885GNAI1 2557/4885

“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.

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