SCHEMBL24110424

SCHEMBL24110424

COc1ccc2c(ccn2CC(C)(C)N2CCOCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 2/20 0.47
▸ PRMT5 O14744 7/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MTNR1A P48039 1/20 0.41
▸ MTNR1B P49286 1/20 0.41
▸ PIK3CD O00329 2/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PIK3CB P42338 1/20 0.38
▸ HTR2A P28223 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
SCHEMBL24110371 0.88 HTR2C (0.50) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL24110422 0.87 HTR2C (0.49) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL25817734 0.82 HTR2C (0.44) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL23927917 0.79 HTR7 (0.58) HTR2CPRMT5KDM4ETSHRMTNR1A
SCHEMBL18997057 0.78 HTR2C (0.59) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL24110213 0.76 HTR2C (0.60) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL24110432 0.74 HTR2C (0.46) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL24110506 0.74 HTR2C (0.46) HTR2CPRMT5KDM4ETSHRCASP1
SCHEMBL24109924 0.73 HTR2C (0.54) HTR2CPRMT5KDM4EMTNR1AMTNR1B
SCHEMBL29904400 0.73 HTR2C (0.54) HTR2CPRMT5KDM4EMTNR1AMTNR1B

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-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 HTR2C 35/4885PRMT5 1869/4885KDM4E 2739/4885

“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.

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