SCHEMBL23956139

SCHEMBL23956139

Clc1ccc2c(ccn2CCN2CC3(CCC3)C2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 4/20 0.47
▸ HTR2A P28223 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ CDK4 P11802 2/20 0.43
▸ CCND1 P24385 2/20 0.43
▸ PRMT5 O14744 1/20 0.40
▸ HTR6 P50406 3/20 0.39
▸ KMO O15229 1/20 0.38
▸ ACLY P53396 2/20 0.36
▸ DRD1 P21728 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ TMEM97 Q5BJF2 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ ADRA1B P35368 1/20 0.36
▸ KRAS P01116 1/20 0.35

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
SCHEMBL23927846 0.85 HTR2A (0.44) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL23956100 0.82 HTR7 (0.52) HTR7HTR2AHTR2CPRMT5
SCHEMBL23927826 0.81 HTR7 (0.63) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL23956138 0.81 HTR7 (0.67) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL23956140 0.81 HTR7 (0.62) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL23927863 0.80 HTR7 (0.61) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL23956108 0.78 HTR7 (0.38) HTR7HTR2C
SCHEMBL23927821 0.76 HTR7 (0.53) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL18856964 0.71 HTR2A (0.59) HTR7HTR2AHTR2CCDK4CCND1
SCHEMBL8959527 0.71 HTR2A (0.59) HTR7HTR2AHTR2CCDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (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-11254640-B2 N-substituted indoles and other heterocycles for treating brain disorders TPH2, AANAT, HTR2C HTR7 32/4885HTR2A 5/4885HTR2C 3/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR7 32/4885HTR2A 5/4885HTR2C 3/4885

“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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