SCHEMBL30516212

SCHEMBL30516212

c1ccc(-c2ccccc2-c2ccc(-c3ccc(-c4ccccc4-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
HSD17B10 Q99714 3/20 0.55
BCL2L1 Q07817 2/20 0.55
MAPK1 P28482 2/20 0.55
HPGD P15428 1/20 0.55
CYP2A6 P11509 1/20 0.55
PTGS2 P35354 1/20 0.54
TAAR1 Q96RJ0 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MMP3 P08254 1/20 0.53
BACE1 P56817 1/20 0.50
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
MEN1 O00255 1/20 0.48
APAF1 O14727 1/20 0.48
NPC1 O15118 1/20 0.48

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
Tannin Pyrogallol SCHEMBL13685561 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL5951150 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL30257106 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL28184105 0.97 ALDH1A1 (0.60) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Biphenyl SCHEMBL1994657 0.96 ALDH1A1 (0.69) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL6754212 0.93 ALDH1A1 (0.55) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL21447 0.93 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
Benzene SCHEMBL28035419 0.93 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL2361430 0.93 ALDH1A1 (0.61) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL31485753 0.90 ALDH1A1 (0.52) ALDH1A1HSD17B10BCL2L1MAPK1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110323256-B Display unit, method of manufacturing the same, and electronic apparatus 索尼公司 2023-07-28 CN disclosed