SCHEMBL6015837

SCHEMBL6015837

O=C1Nc2ccccc2OC1=Cc1c[nH]c2cc(C(=O)O)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ALOX5 P09917 3/20 0.48
PIK3CA P42336 2/20 0.43
MTOR P42345 2/20 0.43
NTRK1 P04629 2/20 0.41
ABL1 P00519 2/20 0.41
DAPK3 O43293 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
CSF1R P07333 1/20 0.41
RET P07949 1/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
LTK P29376 1/20 0.41
GRK5 P34947 1/20 0.41

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
SCHEMBL6015835 1.00 MEN1 (0.51) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6015917 0.88 NPC1 (0.64) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6015914 0.88 NPC1 (0.64) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6015997 0.83 MEN1 (0.60) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6015995 0.83 MEN1 (0.60) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6015638 0.80 NPC1 (0.43) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL6016071 0.77 KDR (0.55) KMT2ANPC1RAB9ANTRK1ABL1
SCHEMBL6016074 0.77 KDR (0.55) KMT2ANPC1RAB9ANTRK1ABL1
SCHEMBL8205587 0.72 NPC1 (0.47) MEN1KMT2ANPC1RAB9APDGFRB
SCHEMBL8205583 0.72 NPC1 (0.47) MEN1KMT2ANPC1RAB9APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049312-B1 Benzothiazinone and benzoxazinone compounds ABBOTT GMBH & CO. KG (DE) 2006-05-23 US disclosed
EP-1181282-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-02-27 EP disclosed
WO-2000075139-A2 BENZOTHIAZINONE AND BENZOXAZINONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2000-12-14 WO disclosed