SCHEMBL12808381

SCHEMBL12808381

CN(P)p1oc2ccc3ccccc3c2c2c(ccc3ccccc32)o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HNF4A P41235 1/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ KDM4E B2RXH2 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL973485 0.86 HNF4A (0.40) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL29424688 0.86 HNF4A (0.40) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL14001440 0.82 KMT2A (0.40) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL12964437 0.79 TDP1 (0.38) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL13296135 0.79 HPGD (0.38) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL2635017 0.79 HNF4A (0.40) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL16676464 0.78 KMT2A (0.43) L3MBTL1RAB9AHPGDTSHRKDM4E
SCHEMBL30664398 0.78 KMT2A (0.43) L3MBTL1RAB9AHPGDTSHRKDM4E
SCHEMBL12786202 0.77 L3MBTL1 (0.35) HNF4AL3MBTL1RAB9ACYP3A4HPGD
SCHEMBL31642941 0.77 L3MBTL1 (0.35) HNF4AL3MBTL1RAB9ACYP3A4HPGD

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-2011045701-A1 SEPARATION OF COMPONENTS FROM A MULTI-COMPONENT HYDROCARBON STREAM WHICH INCLUDES ETHYLENE SASOL TECHNOLOGY (PROPRIETARY) LIMITED (ZA) 2011-04-21 — — WO disclosed
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