SCHEMBL19377380

SCHEMBL19377380

O=C(NCc1ccccc1)Nc1ccc(S(=O)(=O)Cc2ccc(CO)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 8/20 0.76
▸ RORC P51449 2/20 0.65
▸ CA2 P00918 3/20 0.64
▸ CA1 P00915 2/20 0.64
▸ CA12 O43570 1/20 0.64
▸ CA9 Q16790 1/20 0.64
▸ PTPN1 P18031 1/20 0.56
▸ HDAC1 Q13547 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.54
▸ GHSR Q92847 1/20 0.54
▸ CYP2C9 P11712 1/20 0.53
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ MAOB P27338 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL20379729 0.86 NAMPT (1.00) NAMPT
SCHEMBL19377285 0.80 NAMPT (0.62) NAMPTRORCCA2CA1CA12
SCHEMBL19377528 0.79 HSD17B10 (0.58) NAMPTRORCCA2CA1CA12
SCHEMBL19377527 0.79 HSD17B10 (0.58) NAMPTRORCCA2CA1CA12
SCHEMBL672160 0.79 CA2 (1.00) NAMPTCA2CA1CA12CA9
SCHEMBL20961799 0.79 RORC (1.00) NAMPTRORCCA2CA1CA12
SCHEMBL19377304 0.78 NAMPT (0.60) NAMPTRORCCA2CA1CA12
SCHEMBL161434 0.78 TSHR (0.59) NAMPTRORCCA2CA1CA12
SCHEMBL10618489 0.78 TSHR (0.63) NAMPTRORCCA2CA1CA12
SCHEMBL20379286 0.78 NAMPT (0.79) NAMPTCA2CA1CA12CA9

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 2317/4885CA2 1681/4885

“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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