SCHEMBL25820381

SCHEMBL25820381

Cc1ccc2c(ccn2[C@H]2CC2N(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TFPI2 P48307 1/20 0.34
ROCK1 Q13464 1/20 0.34
FABP4 P15090 2/20 0.32
HSP90AA1 P07900 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2A6 P11509 2/20 0.31
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
MAOB P27338 1/20 0.31
PRMT5 O14744 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
SCHEMBL24109740 1.00 HTR2A (0.37) HTR2AHTR2CMAPTRXFP1TFPI2
SCHEMBL24109741 0.88 HTR2A (0.37) HTR2AHTR2CFABP4CYP1A2CYP2A6
SCHEMBL25817984 0.87 TFPI2 (0.36) HTR2AHTR2CMAPTRXFP1TFPI2
SCHEMBL25819158 0.87 TFPI2 (0.36) HTR2AHTR2CMAPTRXFP1TFPI2
SCHEMBL24110272 0.87 TFPI2 (0.36) HTR2AHTR2CMAPTRXFP1TFPI2
SCHEMBL24109704 0.84 HTR2A (0.38) HTR2AHTR2CTFPI2FABP4MAOB
SCHEMBL25820588 0.83 SCN9A (0.32)
SCHEMBL24110197 0.83 SCN9A (0.32)
SCHEMBL24109711 0.81 HTR2C (0.42) HTR2AHTR2CTFPI2ROCK1FABP4
SCHEMBL25820772 0.81 HTR2C (0.42) HTR2AHTR2CTFPI2ROCK1FABP4

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 HTR2A 10/4885HTR2C 35/4885MAPT 254/4885

“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.