Acetonitrile

Acetonitrile

SCHEMBL20135601

CC#N.COC1CCCC1

nearest known ligand 0.33

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Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 2/20 0.33
▸ SLC6A3 Q01959 2/20 0.33

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
Water SCHEMBL29472170 0.88 — —
Water SCHEMBL28147067 0.85 — —
SCHEMBL20532 0.85 — —
SCHEMBL112370 0.82 CA1 (0.38) —
SCHEMBL21237759 0.82 CA1 (0.38) —
SCHEMBL1472301 0.82 CA1 (0.38) —
Hydrochloric Acid SCHEMBL1162671 0.82 — —
Ammonia Solution, Strong SCHEMBL8078551 0.82 — —
SCHEMBL607695 0.82 CA1 (0.38) —
SCHEMBL40788 0.82 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200207723-A1 UNSATURATED HYDROCARBON PYRIMIDINE THIOETHER COMPOUNDS AND PREPARATION METHOD AND APPLICATION THEREOF ZHEJIANG UNIVERSITY OF TECHNOLOGY (CN) 2020-07-02 — — US claimed
EP-3321271-B1 METHOD FOR PRODUCING 7H-PYRROLO[2, 3-D]PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF JAPAN TOBACCO INC (JP) 2024-05-29 — — EP disclosed
US-20220409536-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2022-12-29 — — US disclosed
US-20210154148-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2021-05-27 — — US disclosed
US-10857105-B2 Compounds and compositions for intracellular delivery of therapeutic agents MordernaTX, Inc. (US) 2020-12-08 — — US disclosed
US-10822354-B2 Method for producing 7h-pyrrolo[2, 3-d]pyrimidine derivative and intermediate thereof JAPAN TOBACCO INC. (JP) 2020-11-03 — — US disclosed
US-20190314292-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS ARES CAPITAL CORPORATION, AS AGENT 2019-10-17 — — US disclosed
EP-3321271-A1 METHOD FOR PRODUCING 7H-PYRROLO[2, 3-D]PYRIMIDINE DERIVATIVE AND INTERMEDIATE THEREOF Japan Tobacco, Inc. (JP) 2018-05-16 — — 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 (6 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-20210154148-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 SLC6A4 4487/4885SLC6A3 3995/4885
US-10857105-B2 Compounds and compositions for intracellular delivery of therapeutic agents LNPK, PLTP, PLIN3 SLC6A4 4487/4885SLC6A3 3995/4885
US-20200207723-A1 UNSATURATED HYDROCARBON PYRIMIDINE THIOETHER COMPOUNDS AND PREPARATION METHOD AND APPLICATION THEREOF DHFR, AHR, DDT SLC6A4 4744/4885SLC6A3 4859/4885
US-10822354-B2 Method for producing 7h-pyrrolo[2, 3-d]pyrimidine derivative and intermediate thereof JAK1, JAK3, JAK2 SLC6A4 2883/4885SLC6A3 2658/4885
US-20190314292-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 SLC6A4 4487/4885SLC6A3 3995/4885
US-20220409536-A1 COMPOUNDS AND COMPOSITIONS FOR INTRACELLULAR DELIVERY OF THERAPEUTIC AGENTS LNPK, PLTP, PLIN3 SLC6A4 4487/4885SLC6A3 3995/4885

“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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