SCHEMBL3480600

SCHEMBL3480600

CC(C)Sc1cc(-c2c(Cl)cc(C(F)(F)F)cc2Cl)ccc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 1/20 0.41
PDE2A O00408 2/20 0.36
GABRP O00591 13/20 0.34
GABRD O14764 13/20 0.34
GABRA1 P14867 13/20 0.34
GABRB1 P18505 13/20 0.34
GABRG2 P18507 13/20 0.34
GABRB3 P28472 13/20 0.34
GABRA5 P31644 13/20 0.34
GABRA3 P34903 13/20 0.34
GABRA2 P47869 13/20 0.34
GABRB2 P47870 13/20 0.34
GABRA4 P48169 13/20 0.34
GABRE P78334 13/20 0.34
GABRA6 Q16445 13/20 0.34
GABRG1 Q8N1C3 13/20 0.34
GABRG3 Q99928 13/20 0.34
GABRQ Q9UN88 13/20 0.34
CCR2 P41597 1/20 0.33
KIF20B Q96Q89 1/20 0.32

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
SCHEMBL3480609 0.85 DDR1 (0.41) DDR1PDE2AGABRPGABRDGABRA1
SCHEMBL3480543 0.85 DDR1 (0.41) DDR1PDE2AGABRPGABRDGABRA1
SCHEMBL3480522 0.81 DDR1 (0.41) DDR1PDE2AGABRPGABRDGABRA1
SCHEMBL3480527 0.80 TDP1 (0.44) DDR1SMN1; SMN2
SCHEMBL3480558 0.75 GABRA2 (0.40) DDR1PDE2AGABRPGABRDGABRA1
SCHEMBL6405865 0.74 GABRP (0.34) PDE2AGABRPGABRDGABRA1GABRB1
SCHEMBL3480812 0.73 GABRP (0.39) PDE2AGABRPGABRDGABRA1GABRB1
SCHEMBL6405867 0.72 NOTUM (0.34) PDE2AGABRPGABRDGABRA1GABRB1
SCHEMBL3480563 0.68 GABRP (0.53) PDE2AGABRPGABRDGABRA1GABRB1
SCHEMBL5961599 0.64 GABRP (0.37) PDE2AGABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767626-B2 3-arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2010-08-03 US disclosed
US-7612105-B2 3-arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2009-11-03 US disclosed
US-20090170883-A1 3-ARYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE AND MITICIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2009-07-02 US disclosed
EP-1076053-B1 3-ARYLPHENYL SULFIDE DERIVATIVES AND INSECTICIDES AND MITICIDES KUMIAI CHEMICAL INDUSTRY CO (JP) 2006-11-29 EP disclosed
US-7037930-B2 3-arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2006-05-02 US disclosed
US-20050171097-A1 3-Arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-08-04 US disclosed
US-20050107383-A1 3-ARYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE AND MITICIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-05-19 US disclosed
US-6858639-B2 3-Arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-02-22 US disclosed
US-20030069242-A1 3-arylphenyl sulfide derivative and insecticide and miticide KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2003-04-10 US disclosed
US-6509354-B1 Insecticides and miticides containing the 3-arylphenyl sulfide derivatives as an active ingredient. KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2003-01-21 US disclosed
EP-1076053-A1 3-ARYLPHENYL SULFIDE DERIVATIVES AND INSECTICIDES AND MITICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2001-02-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090170883-A1 3-ARYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE AND MITICIDE CBR3, MSRB3, CYP1B1 DDR1 1843/4885PDE2A 3449/4885GABRP 2421/4885
US-20030069242-A1 3-arylphenyl sulfide derivative and insecticide and miticide CYP1B1, CYP2B6, CBR3 DDR1 1237/4885PDE2A 2453/4885GABRP 2277/4885
US-20050171097-A1 3-Arylphenyl sulfide derivative and insecticide and miticide CBR3, MSRB3, CYP1B1 DDR1 1843/4885PDE2A 3449/4885GABRP 2421/4885
US-20050107383-A1 3-ARYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE AND MITICIDE CBR3, MSRB3, CYP1B1 DDR1 1843/4885PDE2A 3449/4885GABRP 2421/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.