SCHEMBL2363066

SCHEMBL2363066

NC(=O)c1ccc2c(c1)NCCS2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HTT P42858 1/20 0.42
LMNA P02545 1/20 0.38
PARP1 P09874 7/20 0.38
TSHR P16473 2/20 0.38
RYR2 Q92736 1/20 0.37
LCK P06239 1/20 0.36
TNKS O95271 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP14 Q460N5 1/20 0.36
PARP10 Q53GL7 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
PARP2 Q9UGN5 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL1238568 0.87 HTT (0.56) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL29978912 0.81 ALDH1A1 (0.60) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL5507018 0.81 ALDH1A1 (0.44) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL753087 0.81 ALDH1A1 (0.60) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL1997763 0.78 HDAC1 (0.46) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL1997553 0.78 HDAC1 (0.46) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL1996452 0.76 L3MBTL1 (0.49) ALDH1A1MEN1GAAKMT2ATSHR
SCHEMBL8038619 0.75 MEN1 (0.53) ALDH1A1MEN1GAAKMT2AHDAC1
SCHEMBL6204345 0.75 MEN1 (0.53) ALDH1A1MEN1GAAKMT2ARYR2
SCHEMBL1997751 0.75 KMT2A (0.54) ALDH1A1MEN1GAAKMT2AHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110301149-A1 COMPOSITIONS AND METHODS FOR TREATING ALCOHOL USE DISORDERS, PAIN AND OTHER DISEASES VM DISCOVERY INC. (US) 2011-12-08 US claimed
US-20250387364-A1 ARSINOTHRICIN AND METHODS OF TREATING INFECTIONS USING ARSINOTHRICIN THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2025-12-25 US disclosed
US-12414932-B2 Arsinothricin and methods of treating infections using arsinothricin THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2025-09-16 US disclosed
US-20250241885-A1 ARSINOTHRICIN AND METHODS OF TREATING INFECTIONS USING ARSINOTHRICIN THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2025-07-31 US disclosed
US-12303485-B2 Arsinothricin and methods of treating infections using arsinothricin THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2025-05-20 US disclosed
US-20220202763-A1 ARSINOTHRICIN AND METHODS OF TREATING INFECTIONS USING ARSINOTHRICIN THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2022-06-30 US disclosed
US-11298335-B2 Arsinothricin and methods of treating infections using arsinothricin THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2022-04-12 US disclosed
US-8729081-B2 Compositions and methods for treating alcohol use disorders, pain and other diseases VM DISCOVERY INC. (US) 2014-05-20 US disclosed
US-20110301149-A1 COMPOSITIONS AND METHODS FOR TREATING ALCOHOL USE DISORDERS, PAIN AND OTHER DISEASES VM DISCOVERY INC. (US) 2011-12-08 US disclosed
EP-2356109-A2 COMPOSITIONS AND METHODS FOR TREATING ALCOHOL USE DISORDERS, PAIN AND OTHER DISEASES VM Discovery, Inc. (US) 2011-08-17 EP disclosed
WO-2010042925-A2 COMPOSITIONS AND METHODS FOR TREATING ALCOHOL USE DISORDERS, PAIN AND OTHER DISEASES VM DISCOVERY INC. (US) 2010-04-15 WO disclosed
WO-2009035997-A2 BENZO-FUSED HETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-03-19 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 (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-20250387364-A1 ARSINOTHRICIN AND METHODS OF TREATING INFECTIONS USING ARSINOTHRICIN ARSA, NAT1, NAA15 ALDH1A1 1037/4885MEN1 2596/4885GAA 825/4885
US-20110301149-A1 COMPOSITIONS AND METHODS FOR TREATING ALCOHOL USE DISORDERS, PAIN AND OTHER DISEASES PRKCH, PRKCG, PRKCQ ALDH1A1 886/4885MEN1 4677/4885GAA 2315/4885

“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.