SCHEMBL27488194

SCHEMBL27488194

c1ccc(Nc2ccc3ccc4c5ccccc5ccc4c3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
HSD17B10 Q99714 6/20 0.62
CYP3A4 P08684 3/20 0.62
HPGD P15428 2/20 0.62
HPRT1 P00492 3/20 0.54
TSHR P16473 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
ALOX15 P16050 2/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
TP53 P04637 1/20 0.50
CDC25B P30305 1/20 0.50
ATM Q13315 1/20 0.50
ALOX12 P18054 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
MAPK1 P28482 1/20 0.50
PTGS2 P35354 1/20 0.50
HTR2B P41595 1/20 0.50

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
SCHEMBL31377546 0.96 ALDH1A1 (0.67) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL16755478 0.96 ALDH1A1 (0.67) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL16541617 0.91 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL16657696 0.90 ALDH1A1 (0.70) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL25734673 0.90 ALDH1A1 (0.61) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL16773295 0.87 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL1551938 0.86 ALDH1A1 (0.62) ALDH1A1HSD17B10CYP3A4HPGDTSHR
SCHEMBL23822809 0.84 ALDH1A1 (0.67) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL24948768 0.84 HPRT1 (0.48) ALDH1A1HSD17B10CYP3A4HPGDHPRT1
SCHEMBL25734716 0.84 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP3A4HPGDHPRT1

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
WO-2024143995-A1 ORGANIC ELECTRIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-07-04 WO disclosed