SCHEMBL6970685

SCHEMBL6970685

C=C(C)c1cn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)nc1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 4/20 0.42
GABRB2 P47870 4/20 0.42
GABRB3 P28472 3/20 0.42
GABRP O00591 2/20 0.42
GABRD O14764 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB1 P18505 2/20 0.42
GABRG2 P18507 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA4 P48169 2/20 0.42
GABRE P78334 2/20 0.42
GABRA6 Q16445 2/20 0.42
GABRG1 Q8N1C3 2/20 0.42
GABRG3 Q99928 2/20 0.42
GABRQ Q9UN88 2/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL6976532 0.88 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL6055780 0.88 GABRA2 (0.45) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL7147083 0.87 GABRA2 (0.43) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL6970880 0.87 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL6055764 0.87 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL6976910 0.87 GABRA2 (0.42) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL7818743 0.86 GABRA2 (0.41) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL7818747 0.86 GABRA2 (0.41) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL6977050 0.86 GABRA2 (0.41) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL7818745 0.86 GABRA2 (0.41) GABRA2GABRB2GABRB3GABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933363-B1 Parasiticidal pyrazoles PFIZER LTD (GB) 2003-08-27 EP disclosed
EP-0946515-B1 PARASITICIDAL PYRAZOLES PFIZER LTD (GB) 2003-03-05 EP disclosed
US-20020173662-A1 Parasiticidal pyrazoles BANKS BERNARD JOSEPH (GB) 2002-11-21 US disclosed
EP-0871617-B1 PARASITICIDAL COMPOUNDS PFIZER (US) 2001-11-14 EP disclosed
US-6255333-B1 HUMANS OR ANIMALS PFIZER INC. 2001-07-03 US disclosed
US-6090394-A FOR HUMANS, ANIMALS PFIZER INC. (US) 2000-07-18 US disclosed
US-6075043-A Parasiticidal pyrazoles PFIZER INC. (US) 2000-06-13 US disclosed
US-6019986-A Parasiticidal pyrazoles PFIZER INC. (US) 2000-02-01 US disclosed
EP-0933363-A1 Parasiticidal pyrazoles Pfizer Limited (GB) 1999-08-04 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 (1 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-20020173662-A1 Parasiticidal pyrazoles HRH3, HRH2, HRH1 GABRA2 535/4885GABRB2 708/4885GABRB3 749/4885

“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.