SCHEMBL19377273

SCHEMBL19377273

CC(NC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CNC3)cc1)c1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 1/20 0.54
▸ DRD2 P14416 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ HTR6 P50406 1/20 0.46
▸ TRPV1 Q8NER1 2/20 0.43
▸ SSTR4 P31391 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ ITGB3 P05106 1/20 0.42
▸ ITGA2B P08514 1/20 0.42
▸ GHSR Q92847 1/20 0.41
▸ ALDH1A1 P00352 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
SCHEMBL19377262 0.86 HTR6 (0.43) IDH1DRD2DRD3HTR6SSTR4
SCHEMBL19377472 0.85 IDH1 (0.46) IDH1TRPV1SSTR4ITGB3ITGA2B
SCHEMBL19377360 0.85 HSD17B10 (0.52) IDH1DRD2DRD3HTR6MEN1
SCHEMBL19377027 0.80 IDH1 (0.58) IDH1TRPV1MEN1KMT2ALMNA
SCHEMBL19377457 0.79 HTR6 (0.45) IDH1DRD2DRD3HTR6LMNA
SCHEMBL19377455 0.79 HTR6 (0.45) IDH1DRD2DRD3HTR6LMNA
SCHEMBL19377425 0.79 PNMT (0.49) IDH1DRD2DRD3HTR6ITGB3
SCHEMBL19377427 0.79 PNMT (0.49) IDH1DRD2DRD3HTR6ITGB3
SCHEMBL14726219 0.75 IDH1 (0.61) IDH1TRPV1LMNA
SCHEMBL24800552 0.74 NAMPT (0.38) IDH1DRD2DRD3HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US claimed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
WO-2017162390-A1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2017-09-28 — — 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-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof UTS2R, GHSR, GRPR IDH1 2402/4885DRD2 4443/4885DRD3 4367/4885

“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.

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