SCHEMBL20711283

SCHEMBL20711283

Nc1ccccc1C(=O)NS(=O)(=O)NC[C@H]1O[C@@H](n2cnc3c(NC4CC4)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.55
▸ ADORA1 P30542 2/20 0.55
▸ PMP22 Q01453 2/20 0.55
▸ ADORA2A P29274 2/20 0.55
▸ ADORA3 P0DMS8 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ ADORA2B P29275 1/20 0.55
▸ HTT P42858 1/20 0.55
▸ SIGMAR1 Q99720 1/20 0.55
▸ SLC29A1 Q99808 1/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL20711326 0.90 RNMT (0.55) —
SCHEMBL20711309 0.88 TRPM2 (0.66) —
SCHEMBL20711196 0.88 TRPM2 (0.69) ADORA1
SCHEMBL20711223 0.85 TRPM2 (0.54) —
SCHEMBL20711281 0.83 TSHR (0.56) TSHRADORA1PMP22ADORA2AADORA3
SCHEMBL20711315 0.81 TRPM2 (0.77) —
SCHEMBL20711220 0.80 TRPM2 (0.61) —
SCHEMBL20711346 0.79 TRPM2 (0.58) —
SCHEMBL20711323 0.79 TRPM2 (0.55) —
SCHEMBL20711284 0.79 TRPM2 (0.56) —

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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2020-12-29 — — US disclosed
US-20190038656-A1 ANTHRANILYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF Memorial Slooan-Kettering Cancer Center (US) 2019-02-07 — — 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-10874686-B2 Anthranilyl-adenosinemonosulfamate analogs and uses thereof ATIC, SLC35B2, ADORA1 TSHR 3317/4885ADORA1 3/4885PMP22 4558/4885
US-20190038656-A1 ANTHRANILYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF ATIC, SLC35B2, ADORA1 TSHR 3317/4885ADORA1 3/4885PMP22 4558/4885

“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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