SCHEMBL16639803

SCHEMBL16639803

O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cc2ccccc2o1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 10/20 0.75
MAPT P10636 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.61
ALOX15 P16050 1/20 0.61
HSD17B10 Q99714 1/20 0.61
ALDH1A1 P00352 1/20 0.60
TP53 P04637 1/20 0.60
HPGD P15428 1/20 0.60
MAPK1 P28482 1/20 0.59
LMNA P02545 1/20 0.58

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
SCHEMBL16639759 0.92 NAMPT (0.73) NAMPTSMN1; SMN2ALDH1A1TP53HPGD
SCHEMBL16639802 0.91 NAMPT (0.75) NAMPTMAPTSMN1; SMN2ALDH1A1TP53
SCHEMBL15246137 0.86 NAMPT (1.00) NAMPT
SCHEMBL16639765 0.84 NAMPT (0.62) NAMPTMAPTSMN1; SMN2ALOX15HSD17B10
SCHEMBL16644181 0.80 NAMPT (0.76) NAMPTMAPTSMN1; SMN2ALOX15HSD17B10
SCHEMBL16639772 0.80 NAMPT (0.76) NAMPTSMN1; SMN2ALOX15HSD17B10ALDH1A1
SCHEMBL16639798 0.80 SMN1; SMN2 (0.78) MAPTSMN1; SMN2HSD17B10ALDH1A1TP53
SCHEMBL10259189 0.79 NAMPT (0.68) NAMPTSMN1; SMN2ALOX15HSD17B10ALDH1A1
SCHEMBL15246471 0.78 SMN1; SMN2 (0.58) NAMPTMAPTSMN1; SMN2ALOX15HSD17B10
SCHEMBL16639761 0.78 NAMPT (0.69) NAMPTMAPTSMN1; SMN2ALDH1A1TP53

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 459/4885MAPT 1118/4885SMN1; SMN2 346/4885
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES STS, SULT1E1, CBS NAMPT 759/4885MAPT 2018/4885SMN1; SMN2 616/4885

“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.