SCHEMBL3715754

SCHEMBL3715754

O=CCc1cc([N+](=O)[O-])c(Sc2cccc(Cl)c2Cl)s1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 12/20 0.72
USP47 Q96K76 6/20 0.60
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
NPSR1 Q6W5P4 1/20 0.36
PDE7A Q13946 3/20 0.36
LMNA P02545 1/20 0.35
PADI4 Q9UM07 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
SCHEMBL3716798 0.91 USP7 (0.59) USP7USP47KDM4EMAPTALDH1A1
SCHEMBL3712957 0.87 USP7 (0.58) USP7USP47PADI4
SCHEMBL3717383 0.84 USP7 (1.00) USP7USP47KDM4EMAPTALDH1A1
SCHEMBL3717157 0.82 USP7 (0.69) USP7USP47MAPTTDP1ITGB2
SCHEMBL3714971 0.81 USP7 (0.48) USP7USP47KDM4EMAPTALDH1A1
SCHEMBL3719652 0.80 USP7 (0.60) USP7USP47MAPTALDH1A1TDP1
SCHEMBL3719301 0.80 USP7 (0.48) USP7USP47PDE7A
SCHEMBL3717084 0.79 USP7 (0.46) USP7USP47MAPTTDP1PDE7A
SCHEMBL3715105 0.78 USP7 (0.45) USP7USP47KDM4EMAPTALDH1A1
SCHEMBL3715750 0.78 USP7 (0.57) USP7USP47TDP1PDE7APADI4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4326327-A1 INHIBITORS OF UBIQUITIN SPECIFIC PEPTIDASE 22 (USP22) AND USES THEREOF FOR TREATING DISEASES AND DISORDERS Northwestern University (US) 2024-02-28 EP claimed
WO-2010114881-A1 ANTI-NEOPLASTIC COMPOUNDS, COMPOSITIONS AND METHODS PROGENRA INC. (US) 2010-10-07 WO claimed
EP-4326327-A1 INHIBITORS OF UBIQUITIN SPECIFIC PEPTIDASE 22 (USP22) AND USES THEREOF FOR TREATING DISEASES AND DISORDERS Northwestern University (US) 2024-02-28 EP disclosed
WO-2010114881-A1 ANTI-NEOPLASTIC COMPOUNDS, COMPOSITIONS AND METHODS PROGENRA INC. (US) 2010-10-07 WO disclosed