SCHEMBL25569725

SCHEMBL25569725

CNC(C)C(Cl)c1ccc2ccsc2c1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.30
HTR3A P46098 1/20 0.30
CYP3A4 P08684 2/20 0.30
CYP2D6 P10635 2/20 0.30
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 2/20 0.30
KCNH2 Q12809 2/20 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
SCHEMBL30429736 0.88 CYP2A6 (0.37)
SCHEMBL25569710 0.88 CYP2A6 (0.37)
SCHEMBL25572162 0.85
SCHEMBL25572155 0.84 CHRNA7 (0.32) CHRNA7HTR3ACYP3A4CYP2D6
SCHEMBL25569728 0.84 HSP90AB1 (0.30)
SCHEMBL25670665 0.81 CYP3A4 (0.46) CHRNA7HTR3ACYP3A4CYP2D6SLC6A2
SCHEMBL25569721 0.81 CHRNA7 (0.30) CHRNA7HTR3ACYP3A4CYP2D6SLC6A2
SCHEMBL25572159 0.81 CYP2D6 (0.32) CHRNA7HTR3ACYP3A4CYP2D6SLC6A2
SCHEMBL25569726 0.81 CYP3A4 (0.31) CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL25572166 0.81

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159487-A1 ADVANTAGEOUS BENZOTHIOPHENE COMPOSITIONS FOR MENTAL DISORDERS OR ENHANCEMENT TACTOGEN INC (US) 2023-05-25 US disclosed
US-20230159487-A1 ADVANTAGEOUS BENZOTHIOPHENE COMPOSITIONS FOR MENTAL DISORDERS OR ENHANCEMENT TACTOGEN INC (US) 2023-05-25 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-20230159487-A1 ADVANTAGEOUS BENZOTHIOPHENE COMPOSITIONS FOR MENTAL DISORDERS OR ENHANCEMENT SLC6A3, CREBBP, SLC1A2 CHRNA7 408/4885HTR3A 402/4885CYP3A4 2923/4885

“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.