SCHEMBL7975540

SCHEMBL7975540

Cn1c(-c2ccccc2)nc2c(OCc3ccccc3)cccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
BRD4 O60885 3/20 0.47
ADORA3 P0DMS8 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
TLR7 Q9NYK1 1/20 0.46
ATP4A P20648 1/20 0.45
ATP4B P51164 1/20 0.45
DAPK1 P53355 1/20 0.44
HTR1A P08908 4/20 0.44
ADRA1D P25100 4/20 0.44
ADRA1A P35348 4/20 0.44
ADRA1B P35368 4/20 0.44
ROCK1 Q13464 1/20 0.43
RAB9A P51151 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42

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
SCHEMBL5173716 0.86 MAPT (0.53) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL15228175 0.84 TLR7 (0.46) L3MBTL1ADORA3ADORA2AADORA1TLR7
SCHEMBL21555490 0.82 ADORA1 (0.53) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7006553 0.81 RAB9A (0.48) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7975777 0.81 ADORA1 (0.46) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7978844 0.81 RHEB (0.49) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7981497 0.80 HTR1A (0.47) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7979040 0.80 ADORA1 (0.46) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7978821 0.80 RAB9A (0.53) MAPTMAPK1TDP1L3MBTL1BRD4
SCHEMBL7976919 0.78 KDM4E (0.45) MAPTMAPK1TDP1L3MBTL1BRD4

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-6194396-B1 ANTIALLERGENS; ANTIINFLAMMATION AGENTS; AUTOIMMUNE DISEASE; ANTISHOCK AGENTS; ANALGESICS; E.G., A 4 OR 7-PHENYLALKYLENE-OXYBENZIMIDAZOLE UNSUBSTITUTED OR SUBSTITUTED IN THE 1,2,3-POSITION WITH AN OXY, AMINO AND/OR THIO GROUP FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
US-6083961-A FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES SUCH AS ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-04 US disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed