SCHEMBL31236760

SCHEMBL31236760

Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1cccs1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.64
EGFR P00533 12/20 0.59
ERBB2 P04626 11/20 0.59
GUSB P08236 1/20 0.58
ALDH1A1 P00352 3/20 0.57
MAPT P10636 2/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
KDM4E B2RXH2 1/20 0.56
POLB P06746 1/20 0.56
PKM P14618 1/20 0.56
HPGD P15428 1/20 0.56
CTDSP1 Q9GZU7 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56

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
Metronidazole Benzoate SCHEMBL366213 0.83 GLA (0.68) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL26231954 0.81 GLA (0.68) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL14185057 0.80 EGFR (0.64) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL3771865 0.80 GLA (0.64) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL3776538 0.80 EGFR (0.67) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL27684676 0.80 GLA (0.64) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL16151836 0.80 GLA (0.78) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL677158 0.80 GLA (0.78) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL3771223 0.79 GUSB (0.71) GLAEGFRERBB2GUSBALDH1A1
SCHEMBL5143254 0.78 GLA (0.76) GLAEGFRERBB2GUSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12408914-B2 Systems and methods for customizing mechanical strength in stimuli-responsive bioabsorbable materials CILAG GMBH INTERNATIONAL (CH) 2025-09-09 US disclosed
EP-4543502-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS Cilag GmbH International (CH) 2025-04-30 EP disclosed
US-20240423617-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 US disclosed
US-20240423620-A1 COMPRESSIBLE SURGICAL ADJUNCTS, CARTRIDGES, AND CARTRIDGE ASSEMBLIES AND METHODS OF MAKING SURGICAL ADJUNCTS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 US disclosed
WO-2024261659-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 WO disclosed