SCHEMBL7855792

SCHEMBL7855792

Cc1c(Cl)cc(C(F)(F)F)c(Cl)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
NOTUM Q6P988 4/20 0.35
RAPGEF4 Q8WZA2 1/20 0.35
LMNA P02545 1/20 0.33
P2RX7 Q99572 2/20 0.32
HSD11B1 P28845 4/20 0.32
IDO1 P14902 2/20 0.32
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
KDR P35968 1/20 0.32
NPFFR2 Q9Y5X5 1/20 0.31
TMPRSS4 Q9NRS4 1/20 0.30

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
SCHEMBL7903146 0.84 TP53 (0.35) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL7894304 0.83 TP53 (0.34) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL2957239 0.80 NOTUM (0.38) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL1764669 0.79 TSHR (0.38) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL28063692 0.79 SMN1; SMN2 (0.50) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL1768795 0.78 CYP3A4 (0.50) NOTUMLMNAIDO1HTR3EHTR3B
SCHEMBL29702062 0.77 P2RX7 (0.33) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL28785582 0.77 P2RX7 (0.33) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL7905835 0.76 TP53 (0.35) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL937606 0.76 TP53 (0.35) TP53CYP2C9CYP2C19SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1137617-A1 METHOD OF MAKING ALPHA-CHLORO-ALPHA-ALPHA-DIFLUORO AROMATIC COMPOUNDS OCCIDENTAL CHEMICAL CORPORATION (US) 2001-10-04 EP disclosed
US-6222078-B1 REACTNG TRICHLORO AROMATIC COMPOUND WITH HYDROGEN FLUORIDE IN PRESENCE OF METAL OXIDE CATLYST OR METAL COMPOUND CATALYST TO FORM CHLORO, DIFLUORO AROMATIC COMPOUND OCCIDENTAL CHEMICAL CORPORATION 2001-04-24 US disclosed
WO-2001005732-A1 REMOVAL OF ANTIMONY COMPOUNDS FROM LIQUIDS OCCIDENTAL CHEMICAL CORPORATION (US) 2001-01-25 WO disclosed
US-6165426-A Method of purifying liquid products by removing soluble antimony compounds therefrom OCCIDENTAL CHEMICAL CORPORATION (US) 2000-12-26 US disclosed
WO-2000034215-A1 METHOD OF MAKING α-CHLORO-α,α-DIFLUORO AROMATIC COMPOUNDS OCCIDENTAL CHEMICAL CORPORATION (US) 2000-06-15 WO disclosed
US-5684049-A HIV-inhibiting benzeneacetamide derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1997-11-04 US disclosed
EP-0538301-B1 HIV-INHIBITING BENZENEACETAMIDE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 1996-10-30 EP disclosed
US-5556886-A VIRICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1996-09-17 US disclosed
EP-0538301-A1 HIV-INHIBITING BENZENEACETAMIDE DERIVATIVES. JANSSEN PHARMACEUTICA NV (BE) 1993-04-28 EP disclosed
WO-1992000952-A1 HIV-INHIBITING BENZENEACETAMIDE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1992-01-23 WO disclosed