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SCHEMBL17190576

SCHEMBL17190576

CCCCCCCC(CCCCCCC)N1C(=O)c2ccc3c4ccc5c6ccc7c8ccc9c%10ccc%11c%12ccc%13c%14ccc%15c%16ccc%17c%18c(ccc(c%19ccc(c%20ccc(c%21ccc(c%22ccc(c%23ccc(c%24ccc(c%25ccc(c2c3%25)C1=O)c4c5%24)c6c7%23)c8c9%22)c%10c%11%21)c%12c%13%20)c%14c%15%19)c%18%16)C(=O)N(C(CCCCCCC)CCCCCCC)C%17=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.42
▸ STAT3 P40763 1/20 0.42
▸ TERT O14746 6/20 0.41
▸ CES1 P23141 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ CDC25A P30304 1/20 0.33
▸ RGS12 O14924 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33

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
SCHEMBL17190559 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL308099 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL19237463 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL7487209 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL12869474 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL15764531 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL7485582 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL15810567 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL22015900 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1
SCHEMBL7479857 1.00 HIF1A (0.42) HIF1ASTAT3TERTCES1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701905-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-07-11 — — US disclosed
US-9701905-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-07-11 — — US disclosed
US-20150299577-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-10-22 — — US disclosed
US-20150299577-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-10-22 — — US disclosed
US-8993209-B2 Positive-type photosensitive resin composition and black bank of an organic light-emitting device including same LG CHEM, LTD. (KR) 2015-03-31 — — US disclosed
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