SCHEMBL23927845

SCHEMBL23927845

C[C@H](Cn1ccc2ccc(F)cc21)N(C)C

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 13/20 0.68
HTR2A P28223 12/20 0.68
HTR7 P34969 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
HTR2B P41595 1/20 0.43
P2RX7 Q99572 1/20 0.40
NPY5R Q15761 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
SCHEMBL23927847 1.00 HTR2C (0.68) HTR2CHTR2AHTR7CYP1A2CYP3A4
SCHEMBL23927935 0.88 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23956069 0.88 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL29780349 0.88 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23927934 0.88 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL26673242 0.84 HTR2C (0.77) HTR2CHTR2AHTR7CYP1A2CYP3A4
SCHEMBL23927858 0.83 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL29780339 0.83 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL23927861 0.83 HTR2C (0.68) HTR2CHTR2ACYP1A2CYP3A4CYP2C9
SCHEMBL7258397 0.82 HTR2C (0.52) HTR2CHTR2AHTR7

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 5/4885HTR7 32/4885
US-20220251040-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR2C 3/4885HTR2A 5/4885HTR7 32/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR2C 3/4885HTR2A 5/4885HTR7 32/4885

“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.