SCHEMBL15936006

SCHEMBL15936006

[c]1ccc2cccc3c2c1-c1ccccc1-3.[c]1cccc2c1ccc1c3ccccc3ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.37
ALDH1A1 P00352 7/20 0.36
HSD17B10 Q99714 6/20 0.36
HPGD P15428 5/20 0.36
TSHR P16473 4/20 0.36
MAPK1 P28482 4/20 0.36
CASP1 P29466 3/20 0.36
HIF1A Q16665 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
CYP1A2 P05177 4/20 0.35
THRB P10828 1/20 0.35
ERBB2 P04626 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33
AHR P35869 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
CYP2A6 P11509 1/20 0.32
CASP7 P55210 2/20 0.31

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
SCHEMBL28132491 0.80 CYP1A2 (0.41) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL534974 0.80 HPRT1 (0.58) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL26787 0.80 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDTSHRMAPK1
SCHEMBL12080528 0.77 HSD17B10 (0.47) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL20774140 0.77 HPRT1 (0.50) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL25108 0.76 ALDH1A1 (0.55) HPRT1ALDH1A1HSD17B10HPGDTSHR
Methane SCHEMBL28133192 0.74 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10HPGDTSHR
Hydroxyl Radical SCHEMBL28094644 0.74 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL27732677 0.74 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10HPGDTSHR
SCHEMBL20774105 0.74 ALDH1A1 (0.41) HPRT1ALDH1A1HSD17B10HPGDTSHR

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-2765832-B1 Multicyclic aromatic compound and organic light emitting device using the same HEESUNG MAT LTD (KR) 2018-04-04 EP claimed
EP-2765832-A1 Multicyclic aromatic compound and organic light emitting device using the same Heesung Material Ltd. (KR) 2014-08-13 EP claimed