SCHEMBL7687637

SCHEMBL7687637

Fc1ccccc1-c1[c]ccc(OC(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.36
PPARG P37231 2/20 0.35
PPARA Q07869 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 2/20 0.32
MEN1 O00255 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTPRC P08575 1/20 0.32
PTPN1 P18031 1/20 0.32
MAPT P10636 2/20 0.31
TSHR P16473 1/20 0.31
ALOX15 P16050 1/20 0.31
DRD1 P21728 1/20 0.31
TAS2R14 Q9NYV8 1/20 0.31
PDE4B Q07343 1/20 0.30
GRM2 Q14416 1/20 0.30
GRM4 Q14833 1/20 0.30

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
SCHEMBL7687772 0.81 GPR3 (0.45) KCNN4NPC1L3MBTL1
SCHEMBL8123605 0.81 RAB9A (0.46) ALDH1A1KMT2ANPC1RAB9AMEN1
SCHEMBL8796671 0.80 KIF11 (0.35) ALDH1A1NPC1RAB9AL3MBTL1MAPT
SCHEMBL434431 0.78 L3MBTL1 (0.38) ALDH1A1NPC1RAB9AL3MBTL1PTPRC
SCHEMBL1410024 0.76 PTPN7 (0.47) ALDH1A1KMT2ANPC1MEN1MAPT
SCHEMBL7678742 0.75 DRD1 (0.40) PPARGPPARAKMT2AMEN1MAPT
SCHEMBL7685171 0.74 DRD1 (0.36) ALDH1A1KMT2AMEN1MAPTTSHR
SCHEMBL8800706 0.74 DRD1 (0.49) KMT2ARAB9AMEN1MAPTDRD1
SCHEMBL900568 0.72 ALOX15 (0.35) ALDH1A1KMT2ARAB9AMEN1MAPT
SCHEMBL432357 0.71 GABRP (0.41) NPC1RAB9APTPRCPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476061-B1 Fungicides containing pyrrolidones as their active agents BASF AKTIENGESELLSCHAFT (DE) 2002-11-05 US disclosed