SCHEMBL8895986

SCHEMBL8895986

CCCNC(=O)c1ccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.46
RAB9A P51151 4/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.43
MAPT P10636 3/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
MMP1 P03956 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
SLC6A5 Q9Y345 1/20 0.41

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
SCHEMBL8065679 0.90 NPC1 (0.56) NPC1RAB9AKMT2ASMN1; SMN2MAPT
SCHEMBL3259018 0.86 HTT (0.43) MMP1HTT
SCHEMBL7979374 0.86 NPC1 (0.44) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL7977366 0.85 NPC1 (0.48) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL7976340 0.84 NPC1 (0.45) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL8063118 0.84 KMT2A (0.46) NPC1RAB9AKMT2ASMN1; SMN2MAPT
SCHEMBL8660004 0.84 MAPT (0.51) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL6549825 0.84 HTT (0.43) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL6547877 0.84 L3MBTL1 (0.51) KMT2ASMN1; SMN2MAPTALDH1A1POLB
SCHEMBL8895486 0.84 NPC1 (0.52) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed