SCHEMBL23328104

SCHEMBL23328104

Cc1cccc(N2CCN(CCNC(=O)c3cc(C)n(-c4ccccc4)n3)CC2)c1C

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 15/20 0.61
HTR2C P28335 15/20 0.61
SLC6A4 P31645 13/20 0.61
KCNH2 Q12809 2/20 0.56
DRD2 P14416 1/20 0.54
DRD3 P35462 1/20 0.54

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
SCHEMBL4248244 0.80 CACNA1G (0.51) HTR2AHTR2CSLC6A4DRD2DRD3
SCHEMBL4251622 0.80 MEN1 (0.52) HTR2AHTR2CSLC6A4DRD2DRD3
SCHEMBL3300566 0.79 KMT2A (0.56) HTR2AHTR2CSLC6A4DRD2
SCHEMBL4251617 0.79 HTR2A (0.49) HTR2AHTR2CSLC6A4DRD2DRD3
SCHEMBL2681699 0.78 HTR2A (0.90) HTR2AHTR2CSLC6A4
SCHEMBL1077440 0.78 HTR2A (0.88) HTR2AHTR2CSLC6A4DRD2DRD3
Hydrochloric Acid SCHEMBL2683212 0.78 HTR2A (0.91) HTR2AHTR2CSLC6A4
SCHEMBL20328177 0.78 HTR2A (0.44) HTR2AHTR2CSLC6A4
SCHEMBL4252495 0.77 CACNA1G (0.53) HTR2AHTR2CSLC6A4DRD2DRD3
SCHEMBL2683102 0.77 HTR2A (0.80) HTR2AHTR2CSLC6A4

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-20210128537-A1 T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF PRAXIS PREC MEDICINES INC (US) 2021-05-06 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-20210128537-A1 T-TYPE CALCIUM CHANNEL MODULATORS AND METHODS OF USE THEREOF CACNA1G, CACNA1H, CACNA1I HTR2A 522/4885HTR2C 1281/4885SLC6A4 252/4885

“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.