SCHEMBL23927853

SCHEMBL23927853

COc1cc2ccn(CC(C)N(C)C)c2cc1OC

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 15/20 0.47
HTR2A P28223 12/20 0.42
PRMT5 O14744 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL23927851 1.00 HTR2C (0.47) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL23956077 1.00 HTR2C (0.47) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL29780356 1.00 HTR2C (0.47) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL23927891 0.90 HTR2C (0.44) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL23927893 0.90 HTR2C (0.44) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL29780336 0.90 HTR2C (0.44) HTR2CHTR2APRMT5CYP1A2CYP3A4
SCHEMBL23927899 0.89 HTR2C (0.51) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23927839 0.89 HTR2C (0.51) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23927838 0.89 HTR2C (0.51) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23927903 0.89 HTR2C (0.51) HTR2CHTR2ACYP1A2CYP3A4CYP2C9

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 HTR2C 3/4885HTR2A 5/4885PRMT5 796/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR2C 3/4885HTR2A 5/4885PRMT5 796/4885

“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.