SCHEMBL24110262

SCHEMBL24110262

COc1ccc2c(ccn2CC(C)(C)N(C)C)c1C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.39
HTR2C P28335 1/20 0.35
NR3C1 P04150 2/20 0.33
NR3C2 P08235 2/20 0.33
PGR P06401 1/20 0.33
KRAS P01116 1/20 0.30
PRMT5 O14744 1/20 0.30
DHFR P00374 1/20 0.30
SLC2A1 P11166 1/20 0.30

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
SCHEMBL24110255 0.86 HTR2C (0.35) GRM2HTR2CNR3C1NR3C2PGR
SCHEMBL24110313 0.85 NR3C1 (0.36) GRM2HTR2CNR3C1NR3C2PGR
SCHEMBL24110244 0.82 GRM2 (0.33) GRM2HTR2CNR3C1NR3C2PGR
SCHEMBL24109778 0.82 HTR2C (0.55) HTR2CNR3C1NR3C2PGRPRMT5
SCHEMBL24110256 0.81 NR3C1 (0.35) GRM2HTR2CNR3C1NR3C2PGR
SCHEMBL24110260 0.80 HTR2C (0.37) GRM2HTR2CKRAS
SCHEMBL24110285 0.78 HTR2A (0.33) HTR2C
SCHEMBL24110258 0.77 HTR2A (0.35) HTR2CNR3C1NR3C2PGR
SCHEMBL24110252 0.74 NR3C1 (0.33) HTR2CNR3C1NR3C2PGR
SCHEMBL24109773 0.74 HTR2C (0.51) HTR2CNR3C1NR3C2PGRPRMT5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
WO-2021252692-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2021-12-16 WO 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 GRM2 27/4885HTR2C 35/4885NR3C1 1240/4885

“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.