SCHEMBL19377256

SCHEMBL19377256

O=C(NCc1ccsc1)Nc1ccc(S(=O)(=O)Cc2ccc3c(c2)CNC3)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 10/20 0.45
▸ RORC P51449 4/20 0.42
▸ MLNR O43193 1/20 0.40
▸ ROCK2 O75116 2/20 0.40
▸ PKN2 Q16513 2/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKG1 Q13976 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 1/20 0.39

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
SCHEMBL19377285 0.86 NAMPT (0.62) NAMPTRORCCA1CA2CA12
SCHEMBL24800494 0.85 RORC (0.52) NAMPTRORCCA1CA2CA12
SCHEMBL19377353 0.85 NAMPT (0.44) NAMPTRORCMLNR
SCHEMBL19377316 0.83 NAMPT (0.54) NAMPTRORCROCK2
SCHEMBL19377434 0.83 MMP2 (0.46) NAMPTRORCMLNR
SCHEMBL19377351 0.81 NAMPT (0.58) NAMPT
SCHEMBL19377016 0.81 NAMPT (0.51) NAMPTRORCMLNR
SCHEMBL19377184 0.80 NAMPT (0.47) NAMPTRORCMLNRCYP2C19CA1
SCHEMBL19377321 0.79 NAMPT (0.58) NAMPTRORCMLNRROCK2PKN2
SCHEMBL19377270 0.79 NAMPT (0.43) NAMPTRORCMLNRROCK2PKN2

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 5 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
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 NAMPT 3742/4885RORC 2317/4885MLNR 24/4885

“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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