SCHEMBL11809289

SCHEMBL11809289

O=C(OCC12COP(OC1)OC2)c1ccc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
MAPT P10636 3/20 0.40
AGTR1 P30556 1/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
GAA P10253 1/20 0.40
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39

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
SCHEMBL10413526 0.73 SMN1; SMN2 (0.57) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL11846287 0.72 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL10412375 0.70 SMN1; SMN2 (0.53) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL522136 0.70 KMT2A (0.59) KMT2AALDH1A1MAPK1HIF1ASMN1; SMN2
SCHEMBL16050507 0.70 SMN1; SMN2 (0.53) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL4975483 0.70 CYP3A4 (0.57) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL8847027 0.70 KMT2A (0.59) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL4618449 0.69 KMT2A (0.41) KMT2AMEN1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL11851665 0.69 KMT2A (0.52) KMT2AMEN1ALDH1A1MAPK1HIF1A
SCHEMBL23716838 0.68 KMT2A (0.53) KMT2AMEN1ALDH1A1MAPK1HIF1A

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
US-3959413-A POLYOLEFIN STABILIZERS CIBA-GEIGY CORPORATION (US) 1976-05-25 US disclosed