SCHEMBL6972773

SCHEMBL6972773

C=Cc1c(C#N)nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRB3 P28472 20/20 0.52
GABRA2 P47869 14/20 0.52
GABRB2 P47870 14/20 0.52
GABRP O00591 10/20 0.52
GABRD O14764 10/20 0.52
GABRA1 P14867 10/20 0.52
GABRB1 P18505 10/20 0.52
GABRG2 P18507 10/20 0.52
GABRA5 P31644 10/20 0.52
GABRA3 P34903 10/20 0.52
GABRA4 P48169 10/20 0.52
GABRE P78334 10/20 0.52
GABRA6 Q16445 10/20 0.52
GABRG1 Q8N1C3 10/20 0.52
GABRG3 Q99928 10/20 0.52
GABRQ Q9UN88 10/20 0.52
NR1I2 O75469 1/20 0.52
LMNA P02545 1/20 0.52
CYP3A4 P08684 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL2002131 0.88 GABRA2 (0.61) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7812275 0.87 GABRB3 (0.55) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7818741 0.84 GABRB3 (0.49) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL2000174 0.80 GABRB3 (0.44) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL6976127 0.80 GABRB3 (0.55) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL2000173 0.80 GABRB3 (0.44) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL7815622 0.78 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL6055918 0.78 GABRB3 (0.53) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL337554 0.78 GABRA2 (0.65) GABRB3GABRA2GABRB2GABRPGABRD
SCHEMBL2839580 0.77 GABRB3 (0.47) GABRB3GABRA2GABRB2GABRPGABRD

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 14 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-6268509-B1 PESTICIDES PFIZER INC 2001-07-31 US 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-0946515-A1 PARASITICIDAL PYRAZOLES Pfizer Limited (GB) 1999-10-06 EP disclosed
EP-0933363-A1 Parasiticidal pyrazoles Pfizer Limited (GB) 1999-08-04 EP disclosed
EP-0871617-A1 PARASITICIDAL COMPOUNDS PFIZER INC. (US) 1998-10-21 EP disclosed
WO-1998024767-A1 PARASITICIDAL PYRAZOLES PFIZER LIMITED (GB) 1998-06-11 WO disclosed
WO-1997007102-A1 PARASITICIDAL COMPOUNDS PFIZER INC (US) 1997-02-27 WO 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 GABRB3 749/4885GABRA2 535/4885GABRB2 708/4885

“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.