SCHEMBL23927892

SCHEMBL23927892

COc1ccc2c(c1)c(C)cn2CC(C)N(C)C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.45
HTR2C P28335 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
ADRB2 P07550 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37

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
SCHEMBL23927889 1.00 HTR6 (0.45) HTR6HTR2CKDM4EALDH1A1HPGD
SCHEMBL29780350 1.00 HTR6 (0.45) HTR6HTR2CKDM4EALDH1A1HPGD
SCHEMBL23956111 0.86 HTR6 (0.45) HTR6HTR2CKDM4EALDH1A1HPGD
SCHEMBL23927866 0.81 HTR2C (0.38) HTR6HTR2C
SCHEMBL29780353 0.81 HTR2C (0.38) HTR6HTR2C
SCHEMBL23927868 0.81 HTR2C (0.38) HTR6HTR2C
SCHEMBL23956109 0.78 HTR6 (0.61) HTR6HTR2C
SCHEMBL23927895 0.76 HTR2C (0.69) HTR2CKDM4EMTNR1AMTNR1B
SCHEMBL23956071 0.76 HTR2C (0.69) HTR2CKDM4EMTNR1AMTNR1B
SCHEMBL23927896 0.76 HTR2C (0.69) HTR2CKDM4EMTNR1AMTNR1B

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 HTR6 10/4885HTR2C 3/4885KDM4E 1049/4885
US-20210332012-A1 N-SUBSTITUTED INDOLES AND OTHER HETEROCYCLES FOR TREATING BRAIN DISORDERS TPH2, AANAT, HTR2C HTR6 10/4885HTR2C 3/4885KDM4E 1049/4885

“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.