SCHEMBL20224893

SCHEMBL20224893

CN(C1CCCCC1)C1(C)CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADH1C P00326 1/20 0.33
▸ ADH1A P07327 1/20 0.33
▸ FAAH O00519 1/20 0.31
▸ PHGDH O43175 1/20 0.31
▸ MGLL Q99685 1/20 0.31

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
Hydrochloric Acid SCHEMBL17848627 0.98 ADH1C (0.32) ADH1CADH1A
SCHEMBL31566746 0.84 — —
SCHEMBL5537606 0.83 ADH1A (0.38) ADH1CADH1AFAAHPHGDHMGLL
SCHEMBL17848401 0.71 GRIN2D (0.32) —
SCHEMBL28221777 0.69 — —
SCHEMBL25633283 0.68 OPRM1 (0.34) —
SCHEMBL2968571 0.67 ADH1C (0.39) ADH1CADH1AFAAHPHGDHMGLL
Piperidine SCHEMBL28075320 0.67 ALDH1A1 (0.45) ADH1CADH1AFAAHPHGDHMGLL
Hydrochloric Acid SCHEMBL1994413 0.66 OPRM1 (0.33) —
SCHEMBL6507193 0.66 HRH4 (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230143552-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2023-05-11 — — US disclosed
US-20230143552-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2023-05-11 — — US disclosed
US-20210147355-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2021-05-20 — — US disclosed
US-10633336-B2 Dopamine D2 receptor ligands THE BROAD INSTITUTE, INC. (US) 2020-04-28 — — US disclosed
US-20180155283-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2018-06-07 — — US disclosed
US-20180155283-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2018-06-07 — — US 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 (4 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-20180155283-A1 DOPAMINE D2 RECEPTOR LIGANDS DRD2, DRD3, ARRB1 ADH1C 1167/4885ADH1A 1950/4885FAAH 829/4885
US-10633336-B2 Dopamine D2 receptor ligands DRD2, ARRB1, DRD3 ADH1C 1212/4885ADH1A 1761/4885FAAH 647/4885
US-20230143552-A1 DOPAMINE D2 RECEPTOR LIGANDS DRD2, SLC6A3, NTSR2 ADH1C 774/4885ADH1A 850/4885FAAH 325/4885
US-20210147355-A1 DOPAMINE D2 RECEPTOR LIGANDS DRD2, SLC6A3, NTSR2 ADH1C 774/4885ADH1A 850/4885FAAH 325/4885

“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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