SCHEMBL9385263

SCHEMBL9385263

Fc1cccc2c(OCCc3cccc(Oc4ccc(Cl)cc4)c3)ncnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
FDFT1 P37268 4/20 0.39
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ADRB1 P08588 2/20 0.37
ADRB3 P13945 2/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
LMNA P02545 1/20 0.36
SLC2A1 P11166 1/20 0.36
AURKA O14965 1/20 0.35
RPS6KB1 P23443 1/20 0.35
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
FAAH O00519 2/20 0.34
KDR P35968 1/20 0.34
CSF1R P07333 1/20 0.34
PDGFRB P09619 1/20 0.34
FLT4 P35916 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
SCHEMBL8546847 0.91 RAB9A (0.41) EGFRFDFT1SMN1; SMN2AURKARPS6KB1
SCHEMBL9383256 0.91 TRPA1 (0.39) EGFRALDH1A1KMT2APPARGLMNA
SCHEMBL8548181 0.85 TRPA1 (0.43) EGFRKMT2ASMN1; SMN2LMNASLC2A1
SCHEMBL8547249 0.84 AURKA (0.45) EGFRSMN1; SMN2PPARGLMNAAURKA
SCHEMBL9385472 0.84 RAB9A (0.52) EGFRFDFT1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL8548684 0.79 RAB9A (0.42) ALDH1A1SMN1; SMN2LMNAAURKARPS6KB1
SCHEMBL8548239 0.79 AURKA (0.44) FDFT1ALDH1A1SMN1; SMN2PPARGSLC2A1
SCHEMBL9389676 0.78 AURKA (0.41) PPARAAURKARPS6KB1CSF1R
SCHEMBL8548719 0.78 MRGPRX1 (0.40) ALDH1A1LMNAAURKARPS6KB1
SCHEMBL8546438 0.78 CNR1 (0.38) LMNAAURKARPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556375-A4 NEMATICIDAL METHOD DOWELANCO (US) 1994-05-18 EP claimed
EP-0556375-A1 NEMATICIDAL METHOD DOWELANCO (US) 1993-08-25 EP claimed
WO-1993004583-A1 NEMATICIDAL METHOD DOWELANCO (US) 1993-03-18 WO claimed