SCHEMBL16644166

SCHEMBL16644166

O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2ccccc2[nH]1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 12/20 0.75
ALDH1A1 P00352 2/20 0.60
MAPT P10636 1/20 0.60
KDM4E B2RXH2 1/20 0.57
HSD17B10 Q99714 1/20 0.57
MEN1 O00255 1/20 0.55
HCRTR1 O43613 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL16644181 0.90 NAMPT (0.76) NAMPTALDH1A1MAPTKDM4EHSD17B10
SCHEMBL1156500 0.89 NAMPT (0.68) NAMPTALDH1A1MAPTKDM4EMEN1
SCHEMBL24948341 0.87 NAMPT (0.72) NAMPTALDH1A1MAPT
SCHEMBL30877552 0.87 NAMPT (0.72) NAMPTALDH1A1MAPT
SCHEMBL12467065 0.86 NAMPT (1.00) NAMPT
SCHEMBL12467143 0.86 NAMPT (1.00) NAMPT
SCHEMBL16644240 0.84 NAMPT (0.68) NAMPTALDH1A1MAPTKDM4EMEN1
SCHEMBL25040298 0.84 NAMPT (0.62) NAMPTALDH1A1MAPTKDM4EMEN1
SCHEMBL16108086 0.82 NAMPT (0.74) NAMPTALDH1A1MAPT
SCHEMBL16644228 0.82 NAMPT (0.65) NAMPTALDH1A1MAPTMEN1KMT2A

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 2 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

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 459/4885ALDH1A1 2853/4885MAPT 1118/4885
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES STS, SULT1E1, CBS NAMPT 759/4885ALDH1A1 2737/4885MAPT 2018/4885

“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.