SCHEMBL23927902

SCHEMBL23927902

COc1cccc2c1ccn2CCN(C)C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.64
HTR2A P28223 3/20 0.54
HTR6 P50406 8/20 0.46
PRMT5 O14744 1/20 0.44
KDR P35968 1/20 0.42
GSK3B P49841 1/20 0.42
HTR1D P28221 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41

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
Fumaric Acid SCHEMBL29435352 0.89 HTR2C (0.55) HTR2CHTR2AHTR6PRMT5KDM4E
Fumaric Acid SCHEMBL23927840 0.89 HTR2C (0.55) HTR2CHTR2AHTR6PRMT5KDM4E
SCHEMBL7958454 0.81 HTR2C (0.60) HTR2CHTR6PRMT5KDRGSK3B
SCHEMBL12543673 0.81 HTR2C (0.60) HTR2CHTR6PRMT5ALDH1A1
SCHEMBL25438171 0.81 HTR2C (0.59) HTR2CHTR2AHTR6HTR1D
SCHEMBL23956093 0.81 HTR2C (0.56) HTR2CHTR2AHTR6
SCHEMBL31703512 0.81 HTR2C (0.59) HTR2CHTR2AHTR6HTR1D
SCHEMBL12542708 0.80 HTR2C (0.58) HTR2CHTR6PRMT5ALDH1A1
SCHEMBL11248096 0.80 HTR6 (0.57) HTR2CHTR2AHTR6KDRGSK3B
SCHEMBL13228252 0.79 HTR2C (0.65) HTR2CHTR6PRMT5KDM4EALDH1A1

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 5 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
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 HTR2C 3/4885HTR2A 5/4885HTR6 10/4885
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR2C 3/4885HTR2A 5/4885HTR6 10/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR2C 3/4885HTR2A 5/4885HTR6 10/4885

“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.