SCHEMBL7364217

SCHEMBL7364217

COC(=O)Oc1cccc2cccnc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 7/20 0.62
LMNA P02545 6/20 0.62
METAP2 P50579 1/20 0.61
METAP1 P53582 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
HSP90AA1 P07900 1/20 0.61
KDM4E B2RXH2 7/20 0.58
POLB P06746 2/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
GAA P10253 2/20 0.57
USP2 O75604 1/20 0.56
ALDH1A1 P00352 4/20 0.55
MAPT P10636 3/20 0.55
NPSR1 Q6W5P4 4/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALOX15 P16050 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.51

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
SCHEMBL28459061 0.90 LMNA (0.69) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL250301 0.83 LMNA (0.65) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL27890151 0.83 LMNA (0.57) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL795857 0.83 HSP90AA1 (0.68) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL10385035 0.83 LMNA (0.72) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL10750474 0.83 LMNA (0.63) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL10752189 0.83 LMNA (0.60) L3MBTL1LMNAMETAP2METAP1HDAC6
SCHEMBL4457246 0.82 LMNA (0.66) L3MBTL1LMNAMETAP2METAP1HDAC6
Hydrochloric Acid SCHEMBL2563239 0.82 LMNA (0.63) L3MBTL1LMNAMETAP2METAP1HDAC6
Butanedione SCHEMBL5530736 0.82 LMNA (0.63) L3MBTL1LMNAMETAP2METAP1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5124455-A Enzyme inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-23 US claimed
EP-0470805-B1 Oxime-carbamates and oxime-carbonates as bronchodilators and anti-inflammatory agents AMERICAN HOME PROD (US) 1994-09-07 EP disclosed
US-5124455-A Enzyme inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-23 US disclosed
EP-0470805-A1 Oxime-carbamates and oxime-carbonates as bronchodilators and anti-inflammatory agents AMERICAN HOME PRODUCTS CORPORATION (US) 1992-02-12 EP disclosed
EP-0208281-B1 QUINOLINE 8-CARBOXYLIC-ACID AZOLIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1991-01-30 EP disclosed
EP-0208281-A2 Quinoline 8-carboxylic-acid azolides, process for their preparation and their use as herbicides BASF Aktiengesellschaft (DE) 1987-01-14 EP disclosed