SCHEMBL24110403

SCHEMBL24110403

COc1ccc2c(ccn2C2CC(N3CCC3)C2)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.44
▸ KDM2B Q8NHM5 9/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HTR6 P50406 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HTR7 P34969 1/20 0.38
▸ TFPI2 P48307 1/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ OPRL1 P41146 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ PRMT5 O14744 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
SCHEMBL24110522 0.96 HTR2C (0.43) HTR2CKDM2BHRH3POLBHTR6
SCHEMBL24110507 0.88 KDM4E (0.41) HTR2CKDM2BHRH3POLBHTR6
SCHEMBL24110142 0.84 HTR2C (0.41) HTR2CKDM2BPOLBHTR6L3MBTL1
SCHEMBL25817962 0.83 HTR2C (0.39) HTR2CKDM2BPOLBHTR6L3MBTL1
SCHEMBL24110524 0.82 HTR2C (0.39) HTR2CKDM2BHRH3POLBHTR6
SCHEMBL17602083 0.81 KDM4C (0.47) HTR2CKDM2BPOLBHTR6L3MBTL1
SCHEMBL24109934 0.81 HTR2C (0.41) HTR2CKDM2BPOLBHTR6L3MBTL1
SCHEMBL24109763 0.80 HTR2C (0.40) HTR2CKDM2BPOLBHTR6L3MBTL1
SCHEMBL24109843 0.80 HTR2C (0.42) HTR2CPOLBHTR6L3MBTL1TFPI2
SCHEMBL24110627 0.80 HTR2C (0.42) HTR2CPOLBHTR6L3MBTL1TFPI2

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 HTR2C 35/4885KDM2B 2802/4885HRH3 845/4885

“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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