SCHEMBL25817629

SCHEMBL25817629

COc1ccc2c(ccn2C2CC2N2CC3(COC3)C2)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.36
▸ TFPI2 P48307 1/20 0.36
▸ TUBB1 Q9H4B7 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ROCK1 Q13464 1/20 0.33
▸ HTR3A P46098 1/20 0.33
▸ ALKBH5 Q6P6C2 1/20 0.33
▸ FTO Q9C0B1 1/20 0.33
▸ PDGFRB P09619 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ FABP4 P15090 1/20 0.32
▸ MTNR1A P48039 1/20 0.32
▸ MTNR1B P49286 1/20 0.32
▸ PRMT5 O14744 1/20 0.31
▸ KDM2B Q8NHM5 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31

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
SCHEMBL25817881 0.91 TFPI2 (0.38) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL25817962 0.86 HTR2C (0.39) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24110142 0.83 HTR2C (0.41) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24109768 0.82 KDM4E (0.41) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24109763 0.82 HTR2C (0.40) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24109767 0.75 HTR2C (0.39) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24109934 0.73 HTR2C (0.41) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL24109936 0.72 KDM4E (0.41) HTR2CTFPI2TUBB1POLBHTR6
SCHEMBL23927843 0.72 HTR7 (0.48) HTR2CMTNR1AMTNR1BPRMT5
SCHEMBL24109901 0.72 HTR2C (0.40) HTR2CTFPI2TUBB1POLBHTR6

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 1 patent. 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

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 35/4885TFPI2 3990/4885TUBB1 216/4885

“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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