SCHEMBL25858305

SCHEMBL25858305

CC1(C)c2ccccc2-c2cc(Nc3ccccc3-c3cccc4ccc5ccccc5c34)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
FADS1 O60427 1/20 0.37
CDC25B P30305 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK14 Q16539 2/20 0.36
NPC1 O15118 1/20 0.34
KLK7 P49862 1/20 0.33
MAPT P10636 2/20 0.32
PDK2 Q15119 3/20 0.32
STK10 O94804 1/20 0.32
SLK Q9H2G2 1/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32

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
SCHEMBL24890009 0.90 FADS1 (0.40) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL16593060 0.87 FADS1 (0.49) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL29458768 0.85 FADS1 (0.39) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL24360452 0.85 FADS1 (0.39) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL23382853 0.84 FADS1 (0.37) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL25125253 0.83 FADS1 (0.37) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL23423969 0.83 FADS1 (0.34) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL19089973 0.83 FADS1 (0.40) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL24432220 0.82 FADS1 (0.35) RAB9AFADS1CDC25BALDH1A1TP53
SCHEMBL20438128 0.81 MAPK14 (0.37) FADS1CDC25BALDH1A1ALOX15TSHR

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-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 US disclosed
US-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 US disclosed