SCHEMBL23956100

SCHEMBL23956100

COc1ccc2c(ccn2CCN2CC3(CCC3)C2)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 2/20 0.52
▸ HTR2C P28335 2/20 0.48
▸ MTNR1A P48039 4/20 0.47
▸ MTNR1B P49286 4/20 0.47
▸ HTR2A P28223 1/20 0.44
▸ PRMT5 O14744 6/20 0.42
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ NCOR2 Q9Y618 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL23927843 0.86 HTR7 (0.48) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL23956108 0.85 HTR7 (0.38) HTR7HTR2CMTNR1AMTNR1B
SCHEMBL23956096 0.82 HTR7 (0.72) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL23927918 0.82 HTR7 (0.68) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL23956095 0.82 HTR7 (0.67) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL23956139 0.82 HTR7 (0.47) HTR7HTR2CHTR2APRMT5
SCHEMBL23927836 0.81 HTR7 (0.67) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL23927917 0.77 HTR7 (0.58) HTR7HTR2CMTNR1AMTNR1BPRMT5
SCHEMBL18857020 0.76 HTR2C (0.59) HTR7HTR2CMTNR1AMTNR1BHTR2A
SCHEMBL18857024 0.74 MTNR1A (0.62) HTR7HTR2CMTNR1AMTNR1BHTR2A

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 32/4885HTR2C 3/4885MTNR1A 61/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR7 32/4885HTR2C 3/4885MTNR1A 61/4885

“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.

Send feedback