SCHEMBL22650227

SCHEMBL22650227

Cc1snc2ccc(S(N)(=O)=O)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.43
CA1 P00915 8/20 0.41
CA2 P00918 4/20 0.41
CA9 Q16790 3/20 0.41
CA12 O43570 2/20 0.41
CA3 P07451 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
PLAU P00749 2/20 0.39
PLG P00747 1/20 0.39
PLAT P00750 1/20 0.39
PIK3CG P48736 1/20 0.39
ILK Q13418 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CASP3 P42574 1/20 0.38

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
SCHEMBL13358856 0.83 ALDH1A1 (0.39) MAPTTDP1ALDH1A1HSD17B10CASP3
SCHEMBL17088291 0.83 CA2 (0.34) MAPTCA2
SCHEMBL20748370 0.81 CA1 (0.42) MAPTPKMCA1CA2CA9
SCHEMBL17088293 0.70 ALDH1A1 (0.32) PLAUALDH1A1HSD17B10
SCHEMBL9722749 0.70 G6PD (0.41) PKMPIK3CGILKALDH1A1HSD17B10
SCHEMBL18074685 0.69 RXFP1 (0.39) ALDH1A1CASP3
SCHEMBL12310673 0.69 TSHR (0.51) MAPTPKMCA1CA2CA9
SCHEMBL11874362 0.68 TDP1 (0.51) MAPTPKMCA1CA2CA9
SCHEMBL11825651 0.67 ELANE (0.62) MAPTPKMCA1CA2CA9
SCHEMBL10303833 0.67 PKM (0.66) PKMCA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200354576-A1 DYEING COMPOSITION, DYED PRODUCT, AND AZO COLORING AGENT FUJIFILM CORPORATION (JP) 2020-11-12 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-20200354576-A1 DYEING COMPOSITION, DYED PRODUCT, AND AZO COLORING AGENT CYP1B1, CYP1A1, NAT1 MAPT 2728/4885PKM 2019/4885CA1 1499/4885

“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.