SCHEMBL24110591

SCHEMBL24110591

CN(C)C1CC1n1ccc2cnccc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.35
CDK2 P24941 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.35
SLC22A12 Q96S37 1/20 0.34
SLC6A2 P23975 2/20 0.33
MKNK2 Q9HBH9 3/20 0.33
MAPT P10636 3/20 0.33
SCN9A Q15858 1/20 0.33
TGFBR1 P36897 3/20 0.31
HSP90AA1 P07900 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
P2RX7 Q99572 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
SCHEMBL24110605 0.88 MAPT (0.40) CDC7CDK2RAPGEF4SLC6A2MAPT
SCHEMBL24110143 0.87 SCN9A (0.35) CDC7CDK2RAPGEF4SLC22A12SLC6A2
SCHEMBL24110147 0.79 CDC7 (0.35) CDC7CDK2RAPGEF4SLC22A12SLC6A2
SCHEMBL25825444 0.78 DRD2 (0.42) SLC6A2
SCHEMBL24110406 0.78 DRD2 (0.42) SLC6A2
SCHEMBL24110222 0.75 NNMT (0.40) MKNK2SCN9A
SCHEMBL24110145 0.75 MAPT (0.38) CDC7CDK2RAPGEF4MAPTSCN9A
SCHEMBL24109740 0.75 HTR2A (0.37) MAPTHSP90AA1
SCHEMBL25820381 0.75 HTR2A (0.37) MAPTHSP90AA1
SCHEMBL24109704 0.73 HTR2A (0.38) SLC6A2SCN9A

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 CDC7 3683/4885CDK2 4029/4885RAPGEF4 718/4885

“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.