SCHEMBL6967743

SCHEMBL6967743

Cc1nn(-c2c(Cl)cc(Cl)cc2Cl)c(N)c1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 9/20 0.48
GABRD O14764 9/20 0.48
GABRA1 P14867 9/20 0.48
GABRB1 P18505 9/20 0.48
GABRG2 P18507 9/20 0.48
GABRB3 P28472 9/20 0.48
GABRA5 P31644 9/20 0.48
GABRA3 P34903 9/20 0.48
GABRA2 P47869 9/20 0.48
GABRB2 P47870 9/20 0.48
GABRA4 P48169 9/20 0.48
GABRE P78334 9/20 0.48
GABRA6 Q16445 9/20 0.48
GABRG1 Q8N1C3 9/20 0.48
GABRG3 Q99928 9/20 0.48
GABRQ Q9UN88 9/20 0.48
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL10370302 0.83 MEN1 (0.47) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6975980 0.83 GABRB3 (0.70) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10540919 0.78 GABRP (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6965177 0.76 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7963111 0.75 KDR (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL5826687 0.74 KDR (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10371340 0.72 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8783671 0.72 HPGD (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10389978 0.70 GABRP (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7581732 0.68 HPGD (0.48) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946515-B1 PARASITICIDAL PYRAZOLES PFIZER LTD (GB) 2003-03-05 EP disclosed
US-6268509-B1 PESTICIDES PFIZER INC 2001-07-31 US disclosed
US-6075043-A Parasiticidal pyrazoles PFIZER INC. (US) 2000-06-13 US disclosed
EP-0946515-A1 PARASITICIDAL PYRAZOLES Pfizer Limited (GB) 1999-10-06 EP disclosed
WO-1998024767-A1 PARASITICIDAL PYRAZOLES PFIZER LIMITED (GB) 1998-06-11 WO disclosed