SCHEMBL8060909

SCHEMBL8060909

Cc1cc(OCC=C(Cl)Cl)cc(C)c1OCCCNC(=O)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.52
RHOC P08134 1/20 0.45
RHOA P61586 1/20 0.45
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSP90AA1 P07900 1/20 0.41
NAMPT P43490 1/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 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
SCHEMBL7976364 0.97 NPC1 (0.48) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL8067253 0.95 NPC1 (0.49) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL8060866 0.93 NPC1 (0.47) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL7976374 0.92 NPC1 (0.46) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL7965797 0.90 NPC1 (0.44) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL7977366 0.89 NPC1 (0.48) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL7979570 0.89 RHOC (0.47) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL8063136 0.88 NPC1 (0.48) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL8050888 0.88 NPC1 (0.47) NPC1RHOCRHOAALDH1A1RAB9A
SCHEMBL7976340 0.86 NPC1 (0.45) NPC1RHOCRHOAALDH1A1RAB9A

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
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