SCHEMBL11073129

SCHEMBL11073129

COc1ccc(-c2nc3c4ccccc4ccc3n2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.55
MAPK9 P45984 1/20 0.53
MAPK14 Q16539 1/20 0.53
TLR7 Q9NYK1 2/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
ALDH1A1 P00352 8/20 0.44
KDM4E B2RXH2 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
MAPT P10636 4/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HPGD P15428 2/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
TP53 P04637 2/20 0.44

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
Hydrochloric Acid SCHEMBL11077145 0.86 PARP1 (0.52) PARP1MAPK9MAPK14ALDH1A1KDM4E
SCHEMBL11184964 0.85 TLR7 (0.51) PARP1MAPK9MAPK14TLR7ALDH1A1
SCHEMBL11281827 0.85 TLR7 (0.44) PARP1MAPK9MAPK14TLR7ALDH1A1
SCHEMBL11182201 0.85 PSEN1 (0.45) PARP1TLR7ALDH1A1KDM4EMAPT
SCHEMBL11082377 0.85 TLR7 (0.47) PARP1MAPK9MAPK14TLR7ALDH1A1
SCHEMBL9611690 0.85 TLR7 (0.61) TLR7ALDH1A1KDM4ESMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL11086416 0.85 PARP1 (0.51) PARP1MAPK9MAPK14ALDH1A1KDM4E
SCHEMBL16692201 0.84 TLR7 (0.48) PARP1MAPK9MAPK14TLR7ALDH1A1
SCHEMBL11078271 0.84 PARP1 (0.50) PARP1MAPK9MAPK14ALDH1A1KDM4E
SCHEMBL11076059 0.84 TLR7 (0.48) PARP1TLR7ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4435417-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1984-03-06 US claimed
EP-0012866-B1 NEW 3H-NAPHTHO(1,2-D)IMIDAZOLES, PROCESSES FOR PREPARING THEM, COMPOUNDS FOR USE AS ANTIINFLAMMATORY AND ANTIMICROBIAL AGENTS AND COMPOSITIONS FOR THAT USE CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1983-01-19 EP claimed
EP-0012866-A1 New 3H-naphtho(1,2-d)imidazoles, processes for preparing them, compounds for use as antiinflammatory and antimicrobial agents and compositions for that use containing them GRUPPO LEPETIT S.P.A. (IT) 1980-07-09 EP claimed
US-4435417-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1984-03-06 US disclosed
EP-0012866-B1 NEW 3H-NAPHTHO(1,2-D)IMIDAZOLES, PROCESSES FOR PREPARING THEM, COMPOUNDS FOR USE AS ANTIINFLAMMATORY AND ANTIMICROBIAL AGENTS AND COMPOSITIONS FOR THAT USE CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1983-01-19 EP disclosed
US-4288335-A REACTING ESTER WITH PHOSPHORUS SULFIDE, METAL OXIDE OROGIL (FR) 1981-09-08 US disclosed
EP-0012866-A1 New 3H-naphtho(1,2-d)imidazoles, processes for preparing them, compounds for use as antiinflammatory and antimicrobial agents and compositions for that use containing them GRUPPO LEPETIT S.P.A. (IT) 1980-07-09 EP disclosed