SCHEMBL25296265

SCHEMBL25296265

COc1ccc2c(ccn2CC(C)N)n1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.57
HTR2A P28223 17/20 0.49
HTR2B P41595 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL24110207 1.00 HTR2C (0.57) HTR2CHTR2AHTR2BCYP1A2CYP3A4
SCHEMBL24110212 0.83 NTRK1 (0.39) HTR2CHTR2AHTR2B
SCHEMBL25295071 0.83 NTRK1 (0.39) HTR2CHTR2AHTR2B
SCHEMBL24110226 0.83 HTR2C (0.39) HTR2CHTR2AHTR2BCYP1A2
SCHEMBL25296034 0.83 HTR2C (0.39) HTR2CHTR2AHTR2BCYP1A2
SCHEMBL31494793 0.80 HTR2C (0.43) HTR2CHTR2AHTR2B
SCHEMBL25630143 0.80 HTR2C (0.43) HTR2CHTR2AHTR2B
SCHEMBL25818055 0.80 HTR2C (0.56) HTR2CHTR2AHTR2BCYP1A2CYP3A4
SCHEMBL24110592 0.79 MTNR1A (0.37) HTR2CHTR2A
SCHEMBL25255161 0.78 NTRK1 (0.40) HTR2C

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
CN-116507625-A Isochromic amine nerve plasticizer and application thereof 德力克斯疗法有限公司 2023-07-28 CN disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 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 (1 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT HTR2C 35/4885HTR2A 10/4885HTR2B 36/4885

“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.