SCHEMBL10114838

SCHEMBL10114838

CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.62
ALDH1A1 P00352 2/20 0.52
CA1 P00915 8/20 0.50
CA2 P00918 8/20 0.50
CA12 O43570 6/20 0.50
CA9 Q16790 6/20 0.50
KDM4E B2RXH2 1/20 0.49
PTPN7 P35236 1/20 0.49
DUSP3 P51452 1/20 0.49
CA7 P43166 2/20 0.48
CA14 Q9ULX7 2/20 0.48
NAMPT P43490 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL10113961 0.88 NAMPT (0.49) RXFP1NAMPTMEN1KMT2ANPSR1
SCHEMBL10113958 0.86 NAMPT (0.66) RXFP1KDM4ENAMPTMEN1KMT2A
SCHEMBL13204270 0.86 ALDH1A1 (0.55) ALDH1A1KDM4ENAMPTMEN1KMT2A
SCHEMBL10133540 0.86 NAMPT (0.50) RXFP1ALDH1A1NAMPTMEN1KMT2A
SCHEMBL10114938 0.86 PTPN1 (0.56) NAMPTMEN1KMT2ANPSR1
SCHEMBL10114691 0.86 ALDH1A1 (0.55) ALDH1A1KDM4ENAMPTMEN1KMT2A
SCHEMBL13204426 0.86 PTPN1 (0.56) NAMPTMEN1KMT2ANPSR1
SCHEMBL10114972 0.86 POLB (0.56) RXFP1ALDH1A1NAMPTMEN1KMT2A
SCHEMBL14424384 0.86 POLB (0.56) RXFP1ALDH1A1NAMPTMEN1KMT2A
SCHEMBL13204281 0.85 L3MBTL1 (0.56) NAMPTMEN1KMT2ANPSR1

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-8115027-B2 NPY Y5 antagonist SHIONOGI & CO., LTD. (JP) 2012-02-14 US disclosed
US-20100292500-A1 NPY Y5 ANTAGONIST KAWANISHI YASUYUKI 2010-11-18 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 (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-20100292500-A1 NPY Y5 ANTAGONIST NPY5R, NPY1R, NPY2R RXFP1 53/4885ALDH1A1 4599/4885CA1 1931/4885

“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.