SCHEMBL17190564

SCHEMBL17190564

CCCCCN1C(=O)c2ccc3c4ccc5c6c(cc(OCCC)c(c7c(OCCC)cc(c2c37)C1=O)c64)C(=O)N(CCCCC)C5=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ MEN1 O00255 2/20 0.43
▸ RGS12 O14924 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ PABPC1 P11940 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TERT O14746 10/20 0.43
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL17190545 0.95 STAT3 (0.47) STAT3HIF1AMEN1RGS12HTT
SCHEMBL15810558 0.90 STAT3 (0.39) STAT3HIF1AMEN1RGS12HTT
SCHEMBL17190565 0.88 STAT3 (0.49) STAT3HIF1AMEN1RGS12HTT
SCHEMBL17190544 0.87 STAT3 (0.46) STAT3HIF1AMEN1RGS12HTT
SCHEMBL17190577 0.85 STAT3 (0.40) STAT3HIF1AMEN1RGS12HTT
SCHEMBL17190557 0.83 STAT3 (0.41) STAT3HIF1AMEN1RGS12HTT
SCHEMBL17190558 0.81 STAT3 (0.43) STAT3HIF1AMEN1RGS12HTT
SCHEMBL2671337 0.81 STAT3 (0.67) STAT3HIF1AMEN1RGS12HTT
SCHEMBL29384023 0.81 STAT3 (0.67) STAT3HIF1AMEN1RGS12HTT
SCHEMBL18379137 0.80 STAT3 (0.65) STAT3HIF1AMEN1RGS12HTT

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 4 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-20160319592-A1 DEVICE FOR REGULATING THE PASSAGE OF LIGHT MERCK PATENT GMBH (DE) 2016-11-03 — — US disclosed
US-20150315473-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-11-05 — — US disclosed
US-20150299577-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-10-22 — — US disclosed
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