SCHEMBL7979672

SCHEMBL7979672

Cc1ccc(C(=O)NCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 4/20 0.48
POLB P06746 2/20 0.43
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP19A1 P11511 1/20 0.43
GSK3B P49841 1/20 0.42
MEN1 O00255 2/20 0.40
NPC1 O15118 2/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MAPK1 P28482 1/20 0.38
WNT1 P04628 1/20 0.37
DYRK1A Q13627 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL8061945 0.91 KMT2A (0.47) KDM4ETDP1KMT2AALDH1A1MEN1
SCHEMBL7977366 0.86 NPC1 (0.48) KMT2APOLBALDH1A1MEN1NPC1
SCHEMBL7982401 0.85 NPC1 (0.45) KDM4ETDP1KMT2APOLBALDH1A1
SCHEMBL7982312 0.85 HDAC3 (0.38) TDP1KMT2APOLBALDH1A1MEN1
SCHEMBL8060916 0.85 HPGD (0.51) KDM4EKMT2APOLBALDH1A1MEN1
SCHEMBL8065679 0.84 NPC1 (0.56) KMT2APOLBALDH1A1NPC1HPGD
SCHEMBL8060882 0.84 RAB9A (0.50) KMT2APOLBALDH1A1MEN1NPC1
SCHEMBL8077400 0.84 MAPT (0.47) KMT2APOLBALDH1A1MEN1NPC1
SCHEMBL8065540 0.84 NPC1 (0.51) KDM4ETDP1KMT2AALDH1A1MEN1
SCHEMBL8075519 0.83 NPC1 (0.49) TDP1KMT2APOLBALDH1A1NPC1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
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