SCHEMBL23927833

SCHEMBL23927833

FC(F)(F)Oc1ccc2c(ccn2CCN2CCOCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 5/20 0.49
▸ BCR P11274 5/20 0.49
▸ RUNX1 Q01196 3/20 0.45
▸ EPHX2 P34913 5/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ BRD4 O60885 1/20 0.44
▸ HTR7 P34969 2/20 0.43
▸ NOS3 P29474 1/20 0.40
▸ NOS1 P29475 1/20 0.40
▸ NOS2 P35228 1/20 0.40

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
SCHEMBL23956106 0.92 HTR7 (0.49) ABL1BCRHTR7
SCHEMBL29780355 0.90 HTR7 (0.50) HTR7NOS3NOS1NOS2
SCHEMBL23927877 0.90 HTR7 (0.50) HTR7NOS3NOS1NOS2
SCHEMBL23956105 0.90 HTR7 (0.53) HTR7
SCHEMBL29780348 0.89 HTR7 (0.49) HTR7NOS3NOS1NOS2
SCHEMBL23927844 0.89 HTR7 (0.49) HTR7NOS3NOS1NOS2
SCHEMBL23927917 0.84 HTR7 (0.58) HTR7
SCHEMBL23956108 0.80 HTR7 (0.38) ABL1BCRHTR7
SCHEMBL14594155 0.76 HTR7 (0.56) HTR7NOS3NOS1NOS2
SCHEMBL28917706 0.76 SCN7A (0.55) HTR7

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-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-08-11 — — US disclosed
US-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-02-22 — — US disclosed
US-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-02-22 — — US disclosed
CN-113840600-A N-substituted indoles and other heterocyclic compounds for treating brain diseases 加利福尼亚大学董事会 2021-12-24 — — CN disclosed
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA CORPORATION 2021-10-28 — — US disclosed
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA CORPORATION 2021-10-28 — — 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 (3 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-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders TPH2, AANAT, HTR2C ABL1 815/4885BCR 4404/4885RUNX1 2602/4885
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C ABL1 815/4885BCR 4404/4885RUNX1 2602/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C ABL1 815/4885BCR 4404/4885RUNX1 2602/4885

“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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