SCHEMBL8065679

SCHEMBL8065679

CCOc1ccc(C(=O)NCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.56
RAB9A P51151 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.48
HPGD P15428 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.45
POLB P06746 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GLA P06280 1/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL8895986 0.90 NPC1 (0.46) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL7977366 0.89 NPC1 (0.48) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL8063118 0.88 KMT2A (0.46) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL7979374 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL8060882 0.88 RAB9A (0.50) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL8065540 0.88 NPC1 (0.51) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL8077400 0.88 MAPT (0.47) NPC1RAB9ASMN1; SMN2HPGDL3MBTL1
SCHEMBL8075519 0.87 NPC1 (0.49) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL8067281 0.87 RAB9A (0.41) NPC1RAB9ASMN1; SMN2HPGDALDH1A1
SCHEMBL7976340 0.86 NPC1 (0.45) NPC1RAB9AHPGDKMT2AALDH1A1

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
EP-0824514-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2000-09-06 EP disclosed
US-6028100-A Dihalopropene compounds, insecticides containing them as active ingredients, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-22 US disclosed
US-5952386-A EXCELLENT INSECTICIDAL ACTIVITY FOR THE CONTROL OF NOXIOUS INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-14 US disclosed
WO-1996033160-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-24 WO disclosed