SCHEMBL8323244

SCHEMBL8323244

FC(F)(F)c1cc(Cl)c(-n2ccc3c(Cl)nccc32)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
GABRA2 P47869 9/20 0.35
GABRB2 P47870 9/20 0.35
CDC7 O00311 1/20 0.35
CDK2 P24941 1/20 0.35
GABRB3 P28472 7/20 0.34
GABRP O00591 3/20 0.34
GABRD O14764 3/20 0.34
GABRA1 P14867 3/20 0.34
GABRB1 P18505 3/20 0.34
GABRG2 P18507 3/20 0.34
GABRA5 P31644 3/20 0.34
GABRA3 P34903 3/20 0.34
GABRA4 P48169 3/20 0.34
GABRE P78334 3/20 0.34
GABRA6 Q16445 3/20 0.34
GABRG1 Q8N1C3 3/20 0.34
GABRG3 Q99928 3/20 0.34
GABRQ Q9UN88 3/20 0.34
RPS6KA5 O75582 1/20 0.34

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
SCHEMBL8320585 0.84 CDC7 (0.39) RECQLCDC7CDK2RPS6KA5ALDH1A1
SCHEMBL8322859 0.83 RORC (0.39) GABRA2GABRB2GABRB3GABRPGABRD
SCHEMBL8323616 0.83 GABRA2 (0.40) GABRA2GABRB2CDC7CDK2GABRB3
SCHEMBL8324428 0.83 RECQL (0.51) RECQLALDH1A1MAPTHPGDTDP1
SCHEMBL18372284 0.71 FGFR1 (0.39) MAPT
SCHEMBL2827266 0.71 BIRC5 (0.50) GABRA2GABRB2CDC7CDK2GABRB3
SCHEMBL8666855 0.70 TDP1 (0.44) ALDH1A1MAPTHPGDTDP1
SCHEMBL8324003 0.69 CDC7 (0.36) GABRA2GABRB2CDC7CDK2GABRB3
SCHEMBL8319454 0.69 MAT2A (0.42) CDC7CDK2ALDH1A1MAPTHPGD
SCHEMBL6867874 0.69 CDC7 (0.42) RECQLGABRA2GABRB2CDC7CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0729470-B1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LTD (GB) 1999-05-12 EP claimed
US-5451566-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES ZENECA LIMITED (GB) 1995-09-19 US claimed
WO-1995014019-A1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LIMITED (GB) 1995-05-26 WO claimed
EP-0729470-B1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LTD (GB) 1999-05-12 EP disclosed
US-5451566-A PREEMERGENCE AND POSTEMERGENCE HERBICIDES ZENECA LIMITED (GB) 1995-09-19 US disclosed
WO-1995014019-A1 HERBICIDAL PYRROLOPYRIDINE COMPOUNDS ZENECA LIMITED (GB) 1995-05-26 WO disclosed