SCHEMBL6327003

SCHEMBL6327003

Cc1ccc(S(=O)(=O)c2ccc3c(c2)CCN(C)CC3)cc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.47
HTR2B P41595 1/20 0.47
HTR6 P50406 11/20 0.46
DRD2 P14416 6/20 0.46
DRD3 P35462 6/20 0.46
HTR2A P28223 5/20 0.46
PNMT P11086 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TSHR P16473 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.40
DRD1 P21728 1/20 0.40

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
SCHEMBL6330764 0.85 HTR2C (0.68) HTR2CHTR2BHTR6PNMT
SCHEMBL3896981 0.74 SLC2A1 (0.41) HTR2CHTR2BHTR6SMN1; SMN2TSHR
SCHEMBL3151103 0.73 ALDH1A1 (0.48) SMN1; SMN2TSHRCYP1A2CYP3A4CYP2D6
SCHEMBL9914244 0.71 POLB (0.51) HTR6SMN1; SMN2TSHRALDH1A1POLB
SCHEMBL9914242 0.71 ALDH1A1 (0.45) SMN1; SMN2CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL16574199 0.71 PTGS2 (0.61) ALDH1A1
SCHEMBL10158484 0.71 PNMT (0.56) HTR2CHTR2BHTR6DRD2DRD3
SCHEMBL6332067 0.71 NOTUM (0.44) HTR2CHTR2BSMN1; SMN2HRH3ALDH1A1
SCHEMBL7510471 0.70 CA12 (0.47) SMN1; SMN2TSHRCYP1A2CYP3A4CYP2D6
SCHEMBL27871204 0.70 CA2 (0.64) ALDH1A1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050176759-A1 7-sulfonyl-3-benzazepine derivatives as modulators of the dopamine receptor and their use for the treatment cns disorders SMITHKLINE BEECHAM P.L.C. (GB) 2005-08-11 US claimed
EP-1456178-A1 7-SULFONYL-3-BENZAZEPINE DERIVATIVES AS MODULATORS OF THE DOPAMINE RECEPTOR AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM PLC (GB) 2004-09-15 EP claimed
WO-2003062205-A1 7-SULFONYL-3-BENZAZEPINE DERIVATIVES AS MODULATORS OF THE DOPAMINE RECEPTOR AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-31 WO claimed
US-20050176759-A1 7-sulfonyl-3-benzazepine derivatives as modulators of the dopamine receptor and their use for the treatment cns disorders SMITHKLINE BEECHAM P.L.C. (GB) 2005-08-11 US disclosed
EP-1456178-A1 7-SULFONYL-3-BENZAZEPINE DERIVATIVES AS MODULATORS OF THE DOPAMINE RECEPTOR AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM PLC (GB) 2004-09-15 EP disclosed
WO-2003062205-A1 7-SULFONYL-3-BENZAZEPINE DERIVATIVES AS MODULATORS OF THE DOPAMINE RECEPTOR AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-31 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-20050176759-A1 7-sulfonyl-3-benzazepine derivatives as modulators of the dopamine receptor and their use for the treatment cns disorders MPL, HTR2B, PDGFRB HTR2C 49/4885HTR2B 2/4885HTR6 55/4885

“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.