SCHEMBL11747144

SCHEMBL11747144

O=C(NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)NC1CCCc2sccc21

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
KMT2A Q03164 5/20 0.44
MEN1 O00255 3/20 0.44
CXCR2 P25025 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ALOX5 P09917 1/20 0.38
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL11687394 0.82 KMT2A (0.67) LMNAKMT2AMEN1POLB
SCHEMBL11269894 0.81 LMNA (0.60) LMNAKMT2AMEN1CXCR2L3MBTL1
SCHEMBL11267633 0.75 LMNA (0.69) LMNAKMT2AMEN1CXCR2
SCHEMBL11687464 0.74 KMT2A (0.44) KMT2AMEN1SMN1; SMN2L3MBTL1ALOX5
SCHEMBL11490644 0.74 LMNA (0.70) LMNAKMT2AMEN1CXCR2SMN1; SMN2
SCHEMBL11273026 0.73 LMNA (0.62) LMNAKMT2AMEN1CXCR2
SCHEMBL11483687 0.72 LMNA (0.92) LMNAKMT2AMEN1CXCR2
SCHEMBL11484377 0.71 KMT2A (0.57) LMNAKMT2AMEN1SMN1; SMN2L3MBTL1
SCHEMBL11401725 0.70 HTT (0.64) LMNAKMT2AMEN1L3MBTL1
SCHEMBL11484122 0.70 LMNA (0.69) LMNAKMT2AMEN1CXCR2SMN1; SMN2

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-4053484-A 1-Benzoyl-3-(4,5,6,7-tetrahydrobenzo [b]thien-4-yl)ureas and 1-benzoyl-3-(4,5,6,7-tetrahydro-7-oxobenzo [b]thien-4-yl)ureas, novel intermediates for the preparation of animal growth promoting agents AMERICAN CYANAMID COMPANY (US) 1977-10-11 US disclosed