SCHEMBL11182201

SCHEMBL11182201

COc1cccc(-c2nc3c4ccccc4ccc3n2C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.45
PSEN2 P49810 1/20 0.45
APH1B Q8WW43 1/20 0.45
NCSTN Q92542 1/20 0.45
APH1A Q96BI3 1/20 0.45
PSENEN Q9NZ42 1/20 0.45
TLR7 Q9NYK1 1/20 0.44
CYP1A2 P05177 7/20 0.44
CYP1A1 P04798 2/20 0.44
CYP1B1 Q16678 2/20 0.44
PARP1 P09874 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL11073129 0.85 PARP1 (0.55) TLR7CYP1A2PARP1ALDH1A1HPGD
SCHEMBL11440934 0.85 TLR7 (0.49) TLR7ALDH1A1KMT2AMEN1MAPT
SCHEMBL11290683 0.84 GRIK2 (0.47) TLR7CYP1A2CYP1A1CYP1B1HPGD
SCHEMBL11076059 0.83 TLR7 (0.48) TLR7CYP1A2PARP1ALDH1A1HPGD
SCHEMBL11436977 0.83 MAOB (0.48) TLR7CYP1A2CYP1A1MAPTADORA2A
SCHEMBL11448810 0.82 SHMT2 (0.48) ALDH1A1HPGDKMT2AHSD17B10KDM4E
SCHEMBL11075432 0.82 SHMT2 (0.48) TLR7PARP1ALDH1A1HPGDKMT2A
SCHEMBL9611690 0.82 TLR7 (0.61) TLR7ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11449199 0.82 TLR7 (0.46) TLR7CYP1A2CYP1A1CYP1B1KMT2A
SCHEMBL11443172 0.79 TLR7 (0.45) TLR7CYP1A2ALDH1A1HPGDKMT2A

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-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-4340607-A Antimicrobial 3H-naphtho[1,2-d]imidazoles GRUPPO LEPETIT S.P.A. (IT) 1982-07-20 US disclosed