SCHEMBL25569645

SCHEMBL25569645

CCC(Cc1ccc2c(c1)CCS2)NC

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.45
SLC6A4 P31645 7/20 0.44
SLC5A2 P31639 1/20 0.34
CTSL P07711 1/20 0.33
ADRB2 P07550 2/20 0.32

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
SCHEMBL24197466 0.89 HTR1B (0.45) HTR1BSLC6A4CTSLADRB2
SCHEMBL25569657 0.87 SLC6A4 (0.46) HTR1BSLC6A4CTSLADRB2
SCHEMBL25569651 0.82 TAAR1 (0.47) HTR1BSLC6A4
SCHEMBL25569516 0.80 SLC6A4 (0.36) SLC6A4SLC5A2CTSL
SCHEMBL25569514 0.80 SLC6A4 (0.36) SLC6A4SLC5A2CTSL
SCHEMBL25569515 0.80 SLC6A4 (0.36) SLC6A4SLC5A2CTSL
SCHEMBL25569513 0.77 SIGMAR1 (0.45) SLC6A4CTSLADRB2
SCHEMBL14172986 0.76 CTSL (0.46) SLC6A4SLC5A2CTSL
SCHEMBL24197473 0.76 SLC6A4 (0.46) HTR1BSLC6A4ADRB2
SCHEMBL25569277 0.76 HTR1B (0.33) HTR1BSLC6A4

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 HTR1B 511/4885SLC6A4 21/4885SLC5A2 763/4885

“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.