SCHEMBL23665698

SCHEMBL23665698

CS(=N)(=O)c1cccc(CO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.44
IKBKB O14920 1/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
NPC1 O15118 1/20 0.40
TNF P01375 1/20 0.40
RAB9A P51151 1/20 0.40
NOD1 Q9Y239 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.39
ADAMTS4 O75173 1/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTR6 P50406 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL31701736 1.00 ENPP2 (0.44) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL646928 0.85 ALDH1A1 (0.50) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL22792266 0.83 KAT6A (0.47) NPC1TNFRAB9ANOD1ALDH1A1
SCHEMBL31700847 0.81 IKBKB (0.46) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL31702333 0.81 IKBKB (0.46) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL31701681 0.81 IKBKB (0.46) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL3468833 0.81 AKR1B1 (0.47) ALDH1A1GAAHSD17B10CA2CA5A
SCHEMBL31192532 0.79 PSIP1 (0.52) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL19277486 0.79 PSIP1 (0.52) ENPP2IKBKBPRSS1PRSS2PRSS3
SCHEMBL23665769 0.79 ENPP2 (0.46) ENPP2IKBKBPRSS1PRSS2PRSS3

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-20250320204-A1 7-AZA BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2025-10-16 US disclosed
WO-2021143923-A1 BORONIC ACID DERIVATIVES 首药控股(北京)股份有限公司 2021-07-22 WO 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-20250320204-A1 7-AZA BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS ENPP1, ENPP3, PDE7A ENPP2 16/4885IKBKB 2672/4885PRSS1 1829/4885

“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.