SCHEMBL9375752

SCHEMBL9375752

COc1ccn2cc(/C=C/c3ccc([N+](=O)[O-])c(OCc4ccccc4)c3)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 5/20 0.41
TLR7 Q9NYK1 4/20 0.41
MAPT P10636 4/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 0.40
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
RAB9A P51151 2/20 0.38
CYP19A1 P11511 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
BACE1 P56817 1/20 0.38
NPC1 O15118 1/20 0.38
USP2 O75604 1/20 0.38
NSD2 O96028 1/20 0.38
HSP90AA1 P07900 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL9375758 1.00 TLR9 (0.41) TLR9TLR7MAPTLMNAMEN1
SCHEMBL9380389 0.90 MAPT (0.39) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9380386 0.90 MAPT (0.39) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9381202 0.87 MAPT (0.44) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9381205 0.87 MAPT (0.44) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9379486 0.82 CTSV (0.43) MAPTLMNAPOLBCA2CA5A
SCHEMBL9379483 0.82 CTSV (0.43) MAPTLMNAPOLBCA2CA5A
SCHEMBL9377591 0.82 ABCB1 (0.38) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9377596 0.82 ABCB1 (0.38) MAPTLMNAMEN1KMT2APOLB
SCHEMBL9378630 0.80 SMN1; SMN2 (0.51) MAPTLMNAMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0356234-B1 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-05-11 EP disclosed
US-5047411-A Antiulcer Agents, H2-Receptor Antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed