SCHEMBL6866331

SCHEMBL6866331

FC(F)(F)c1cc(Cl)c(-n2cc(C3CC3(Cl)Cl)nn2)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 7/20 0.67
GABRB2 P47870 7/20 0.67
GABRB3 P28472 1/20 0.43

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
SCHEMBL6866073 0.88 GABRA2 (0.65) GABRA2GABRB2GABRB3
SCHEMBL6870374 0.73 GABRA2 (0.64) GABRA2GABRB2GABRB3
SCHEMBL9219629 0.72 GABRA2 (0.71) GABRA2GABRB2GABRB3
SCHEMBL6860160 0.72 GABRA2 (0.59) GABRA2GABRB2GABRB3
SCHEMBL6055634 0.72 GABRB3 (0.43) GABRA2GABRB2GABRB3
SCHEMBL6867861 0.71 GABRA2 (0.65) GABRA2GABRB2GABRB3
SCHEMBL9214661 0.71 GABRA2 (0.61) GABRA2GABRB2GABRB3
SCHEMBL6870981 0.71 GABRA2 (0.61) GABRA2GABRB2GABRB3
SCHEMBL27257488 0.70 GABRA2 (0.63) GABRA2GABRB2GABRB3
SCHEMBL10430968 0.68 GABRA2 (0.57) GABRA2GABRB2GABRB3

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-20030130307-A1 Heterocycles BANKS BERNARD JOSEPH (GB) 2003-07-10 US claimed
US-6525079-B2 Antiparasitic compounds such as 4-(2,2-dibromocyclopropyl)-1-(2,6-dichloro-4-trifluoromethylphenyl)-1,2,3 -triazole PFIZER INC. 2003-02-25 US claimed
US-20010005725-A1 Heterocycles BANKS BERNARD JOSEPH (GB) 2001-06-28 US claimed
US-6083965-A ANTIPARASITIC AGENTS PFIZER INC (US) 2000-07-04 US claimed
EP-0957094-A1 1-(2-Halogenaryl)azoles as antiparasitic agents PFIZER INC. (US) 1999-11-17 EP claimed
US-6812241-B2 FOR PLANTS, HUMANS, VETERINARY MEDICINE PFIZER INC. 2004-11-02 US disclosed
US-20030130307-A1 Heterocycles BANKS BERNARD JOSEPH (GB) 2003-07-10 US disclosed
US-6525079-B2 Antiparasitic compounds such as 4-(2,2-dibromocyclopropyl)-1-(2,6-dichloro-4-trifluoromethylphenyl)-1,2,3 -triazole PFIZER INC. 2003-02-25 US disclosed
US-6110958-A PARASITICIDES PFIZER INC. (US) 2000-08-29 US disclosed
US-6083965-A ANTIPARASITIC AGENTS PFIZER INC (US) 2000-07-04 US disclosed
EP-0957094-A1 1-(2-Halogenaryl)azoles as antiparasitic agents PFIZER INC. (US) 1999-11-17 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 (2 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-20030130307-A1 Heterocycles CYP1A1, CYP2E1, CYP1B1 GABRA2 2526/4885GABRB2 1986/4885GABRB3 2239/4885
US-20010005725-A1 Heterocycles CYP1A1, CYP2E1, CYP1B1 GABRA2 2526/4885GABRB2 1986/4885GABRB3 2239/4885

“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.