SCHEMBL22837895

SCHEMBL22837895

Nc1ccccc1/C=C/S(=O)(=O)NC[C@H]1OC[C@](N)(n2cnc3c(N)ncnc32)[C@@H]1N

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.34
▸ PI4K2B Q8TCG2 1/20 0.34
▸ PI4K2A Q9BTU6 1/20 0.34
▸ PI4KB Q9UBF8 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ SLC28A1 O00337 1/20 0.33

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
SCHEMBL22837883 0.85 ADORA3 (0.37) ADORA3ADORA2ASLC28A1
SCHEMBL22837934 0.78 PDE4A (0.37) ADORA3ADORA2A
SCHEMBL22837902 0.77 NPEPPS (0.33) —
SCHEMBL20711329 0.77 ADORA3 (0.52) ADORA3
SCHEMBL22837901 0.76 AHCY (0.43) —
SCHEMBL22837920 0.75 ADORA3 (0.35) ADORA3ADORA2ASLC28A1
SCHEMBL20711308 0.75 POLB (0.49) —
SCHEMBL22837900 0.75 ADORA3 (0.36) ADORA3ADORA2ASLC28A1
SCHEMBL20711215 0.74 DPP4 (0.58) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL20711304 0.73 BCHE (0.44) PI4KAPI4K2BPI4K2API4KBADORA2A

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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2020-12-29 — — 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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof ATIC, SLC35B2, ADORA1 PI4KA 2340/4885PI4K2B 3618/4885PI4K2A 3585/4885

“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.

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