SCHEMBL7976374

SCHEMBL7976374

Cc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCCNC(=O)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.46
RAB9A P51151 3/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
RHOC P08134 1/20 0.40
RHOA P61586 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSP90AA1 P07900 1/20 0.39
KMT2A Q03164 2/20 0.39
CNR1 P21554 2/20 0.38
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL8067253 0.97 NPC1 (0.49) NPC1RAB9ARHOCRHOATDP1
SCHEMBL7976364 0.95 NPC1 (0.48) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL7976340 0.93 NPC1 (0.45) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL8060909 0.92 NPC1 (0.52) NPC1RAB9ARHOCRHOATDP1
SCHEMBL7976125 0.91 RHOC (0.44) NPC1RAB9ARHOCRHOATMEM97
SCHEMBL7965797 0.90 NPC1 (0.44) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL7977366 0.90 NPC1 (0.48) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL7977788 0.89 NPC1 (0.43) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL7965704 0.88 RHOC (0.42) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL7979391 0.88 RHOC (0.47) NPC1RHOCRHOAALDH1A1MAPT

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 6 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
EP-0824514-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-02-25 EP 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