SCHEMBL22458035

SCHEMBL22458035

C[C@H]1CCc2sc(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.31
HTR2C P28335 3/20 0.31
HTR2B P41595 3/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL22458033 1.00 HTR2A (0.31) HTR2AHTR2CHTR2BL3MBTL1
SCHEMBL2994718 0.76 HTR2C (0.56) HTR2AHTR2CHTR2B
SCHEMBL12024874 0.75
SCHEMBL22458037 0.73 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL13845087 0.69 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL22458036 0.65
SCHEMBL22458038 0.65
SCHEMBL31563807 0.63 DRD2 (0.38) L3MBTL1
SCHEMBL31563923 0.63 DRD2 (0.38) L3MBTL1
SCHEMBL31564100 0.63 DRD2 (0.38) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219974-A1 ANTHELMINTIC AZA-BENZOTHIOPHENE AND AZA-BENZOFURAN COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2023-07-13 US disclosed
US-11560388-B2 Anthelmintic aza-benzothiophene and aza-benzofuran compounds BOEHRINGER INGELHEIM VETMEDICA GMBH 2023-01-24 US disclosed
US-20200299304-A1 ANTHELMINTIC AZA-BENZOTHIOPHENE AND AZA-BENZOFURAN COMPOUNDS BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2020-09-24 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 (3 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-20200299304-A1 ANTHELMINTIC AZA-BENZOTHIOPHENE AND AZA-BENZOFURAN COMPOUNDS TPMT, NAT1, HNMT HTR2A 3328/4885HTR2C 1814/4885HTR2B 2193/4885
US-11560388-B2 Anthelmintic aza-benzothiophene and aza-benzofuran compounds TPMT, NAT1, HNMT HTR2A 3328/4885HTR2C 1814/4885HTR2B 2193/4885
US-20230219974-A1 ANTHELMINTIC AZA-BENZOTHIOPHENE AND AZA-BENZOFURAN COMPOUNDS TPMT, NAT1, HNMT HTR2A 3328/4885HTR2C 1814/4885HTR2B 2193/4885

“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.