SCHEMBL16639772

SCHEMBL16639772

O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc2ccccc2s1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 11/20 0.76
MAPK1 P28482 1/20 0.57
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 2/20 0.54
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
POLB P06746 1/20 0.53
BLM P54132 1/20 0.53
ALDH1A1 P00352 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
SCHEMBL16639782 0.87 NAMPT (0.70) NAMPTALOX15SMN1; SMN2HSD17B10LMNA
SCHEMBL15246140 0.87 NAMPT (1.00) NAMPT
SCHEMBL16639784 0.85 NAMPT (0.65) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL16639803 0.80 NAMPT (0.75) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL16639787 0.79 SMN1; SMN2 (0.55) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL16644181 0.78 NAMPT (0.76) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL15246471 0.77 SMN1; SMN2 (0.58) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL16639765 0.77 NAMPT (0.62) NAMPTMAPK1ALOX15SMN1; SMN2HSD17B10
SCHEMBL15530852 0.77 NAMPT (1.00) NAMPTALDH1A1
SCHEMBL10280400 0.77 NAMPT (1.00) NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates Valo Health, LLC 2020-06-30 US disclosed
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES VALO HEALTH, INC. 2015-04-16 US disclosed
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES VALO HEALTH, INC. 2015-04-16 US 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 (2 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-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates STS, SQOR, SULT1E1 NAMPT 459/4885MAPK1 3804/4885ALOX15 230/4885
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES STS, SULT1E1, CBS NAMPT 759/4885MAPK1 3941/4885ALOX15 228/4885

“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.