SCHEMBL11076059

SCHEMBL11076059

COc1ccc2c(ccc3c2nc(-c2ccccc2)n3C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.48
PARP1 P09874 1/20 0.47
KDM4E B2RXH2 5/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GRIK2 Q13002 2/20 0.44
GRIK1 P39086 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
ACSS2 Q9NR19 1/20 0.43

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 SCHEMBL11086416 0.91 PARP1 (0.51) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL11076859 0.85 APP (0.44) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL11078271 0.84 PARP1 (0.50) PARP1KDM4EALDH1A1HPGDRAB9A
SCHEMBL11073129 0.84 PARP1 (0.55) TLR7PARP1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL11290186 0.84 KMT2A (0.42) KDM4ESMN1; SMN2ALDH1A1HPGDRAB9A
SCHEMBL11182201 0.83 PSEN1 (0.45) TLR7PARP1KDM4EALDH1A1HPGD
SCHEMBL11289272 0.83 KDM4E (0.50) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL11086406 0.83 PARP1 (0.46) PARP1KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL11081129 0.82 PARP1 (0.48) PARP1KDM4EALDH1A1HPGDRAB9A
SCHEMBL11083854 0.82 PARP1 (0.46) PARP1CYP1A2

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
US-4435417-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1984-03-06 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