SCHEMBL11026052

SCHEMBL11026052

COc1ccc(-c2nc3c4ccccc4ccc3n2CCO)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
KDM4E B2RXH2 8/20 0.50
LMNA P02545 3/20 0.50
TSHR P16473 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
GAA P10253 2/20 0.50
SMN1; SMN2 Q16637 5/20 0.49
MAPK9 P45984 1/20 0.47
MAPK14 Q16539 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
TLR7 Q9NYK1 2/20 0.47
HSD17B10 Q99714 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 4/20 0.45
TP53 P04637 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
DHODH Q02127 1/20 0.45

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
SCHEMBL11079355 0.87 ALDH1A1 (0.55) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11079618 0.86 GRIK2 (0.52) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11074861 0.82 TLR7 (0.52) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11089329 0.82 KDM4E (0.65) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11073129 0.82 PARP1 (0.55) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11078944 0.79 MAPK9 (0.50) ALDH1A1KDM4ELMNATSHRNPSR1
Tomoxiprole SCHEMBL525023 0.77 MAPK9 (0.50) ALDH1A1KDM4ELMNANPSR1SMN1; SMN2
SCHEMBL11024220 0.77 MAPK9 (0.50) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11085482 0.76 MAPK9 (0.47) ALDH1A1KDM4ELMNATSHRNPSR1
SCHEMBL11078342 0.76 TLR8 (0.54) ALDH1A1KDM4ELMNATSHRNPSR1

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-0041630-B1 NEW 3H-NAPHTHO(1,2-D)IMIDAZOLES, THE PROCESS FOR PREPARING THEM, THE COMPOUNDS FOR USE AS ANTIINFLAMMATORY AGENTS AND COMPOSITIONS CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1985-03-13 EP disclosed
US-4411907-A ANALGESICS, ANTIPYRETICS GRUPPO LEPETIT, S.P.A. (IT) 1983-10-25 US disclosed