SCHEMBL739874

SCHEMBL739874

CCN1Cc2cccc3c2c(cn3S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.58
DRD2 P14416 2/20 0.45
DRD3 P35462 2/20 0.45
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
Trifluoroacetic Acid SCHEMBL765583 0.91 HTR6 (0.50) HTR6DRD2DRD3HTR2AHTR2C
SCHEMBL742305 0.90 HTR6 (0.54) HTR6DRD2DRD3HTR2CCYP3A4
Hydrochloric Acid SCHEMBL742236 0.89 HTR6 (0.53) HTR6DRD2DRD3HTR2CCYP3A4
SCHEMBL742701 0.85 HTR6 (0.62) HTR6DRD2HTR2AHTR2CCYP3A4
SCHEMBL744001 0.84 HTR6 (0.53) HTR6DRD2DRD3
SCHEMBL741054 0.83 HTR6 (0.48) HTR6DRD3HTR2AHTR2C
SCHEMBL742406 0.81 KMT2A (0.44) HTR6HTR2C
SCHEMBL741078 0.79 CA2 (0.38) HTR6DRD2
SCHEMBL741618 0.79 HTR6 (0.57) HTR6DRD2DRD3HTR2AHTR2C
SCHEMBL740236 0.79 HTR6 (0.57) HTR6DRD2DRD3HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134714-A1 TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY Biovitrum AB (publ) (SE) 2009-12-23 EP claimed
US-20080293694-A1 New compounds BIOVITRUM AB (PUBL.) (SE) 2008-11-27 US claimed
WO-2008110598-A1 TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY BIOVITRUM AB (PUBL) (SE) 2008-09-18 WO claimed
US-8138333-B2 Sulfonyl-indole derivatives PROXIMAGEN LIMITED (GB) 2012-03-20 US disclosed
US-8138333-B2 Sulfonyl-indole derivatives PROXIMAGEN LIMITED (GB) 2012-03-20 US disclosed
US-20080293694-A1 New compounds BIOVITRUM AB (PUBL.) (SE) 2008-11-27 US disclosed
US-20080293694-A1 New compounds BIOVITRUM AB (PUBL.) (SE) 2008-11-27 US disclosed
WO-2008110598-A1 TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY BIOVITRUM AB (PUBL) (SE) 2008-09-18 WO 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-20080293694-A1 New compounds HTR6, HTR1A, HTR1B HTR6 1/4885DRD2 40/4885DRD3 81/4885

“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.