SCHEMBL25569512

SCHEMBL25569512

CCNCCc1ccc2c(c1)CCS2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
HTR2A P28223 1/20 0.36
HTR1E P28566 1/20 0.36
HTR7 P34969 1/20 0.36
HTR2B P41595 1/20 0.36
HTR5A P47898 1/20 0.36
CTSL P07711 1/20 0.34
KMT2A Q03164 1/20 0.34
RYR2 Q92736 1/20 0.34
SLC6A4 P31645 2/20 0.33
SLC5A2 P31639 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
ATM Q13315 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
SMPD1 P17405 1/20 0.30
ALDH1A1 P00352 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 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
SCHEMBL24989070 0.84 MAPT (0.45) KMT2ARYR2SLC5A2ATMSIGMAR1
SCHEMBL14172986 0.79 CTSL (0.46) CTSLRYR2SLC6A4SLC5A2ALDH1A1
SCHEMBL20562497 0.77 RYR2 (0.42) KMT2ARYR2L3MBTL1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL20562683 0.74 KDM4E (0.42) HTR1AHTR2AKMT2ASLC5A2L3MBTL1
SCHEMBL25569513 0.74 SIGMAR1 (0.45) HTR2AHTR2BCTSLSLC6A4SIGMAR1
SCHEMBL25569657 0.72 SLC6A4 (0.46) HTR1BCTSLSLC6A4
SCHEMBL3939490 0.72 LMNA (0.36) CTSLKMT2ASLC6A4SLC5A2ALDH1A1
SCHEMBL10388342 0.72 CNR1 (0.39) HTR2BCTSLALDH1A1
SCHEMBL5757690 0.72 SLC5A2 (0.42) CTSLKMT2ASLC6A4SLC5A2ALDH1A1
SCHEMBL30627699 0.71 SMN1; SMN2 (0.52) HTR1AHTR1DSLC6A4L3MBTL1ATM

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 HTR1A 456/4885HTR1D 905/4885HTR1B 511/4885

“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.