SCHEMBL8067788

SCHEMBL8067788

Fc1cnc(OC(c2ccnc3cc(Cl)ccc23)C(F)(F)F)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.40
SOS2 Q07890 1/20 0.40
CYP1A2 P05177 2/20 0.37
AAK1 Q2M2I8 2/20 0.37
MAPT P10636 3/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
CCR1 P32246 1/20 0.36
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHKA P35790 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35
THRB P10828 1/20 0.35
FERMT2 Q96AC1 1/20 0.34
MEN1 O00255 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
SCHEMBL8068792 0.73 NR4A2 (0.49) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL24420728 0.68 NR4A2 (0.58) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL21160763 0.68 NR4A2 (0.56) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL8067745 0.68 NR4A2 (0.43) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL4355081 0.66 NR4A2 (0.61) NR4A2SOS2CYP1A2MAPTKMT2A
SCHEMBL5591876 0.65 NR4A2 (0.46) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL669631 0.65 NR4A2 (0.56) NR4A2SOS2CYP1A2AAK1MAPT
SCHEMBL5275609 0.65 NR4A2 (0.56) NR4A2SOS2CYP1A2MAPTALDH1A1
SCHEMBL9229271 0.64 NR4A2 (0.51) NR4A2SOS2CYP1A2AAK1MAPT
SCHEMBL4365534 0.64 FERMT2 (0.55) NR4A2SOS2CYP1A2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6117884-A 4-substituted quinoline derivatives having fungicidal activity DAEUBLE JOHN (US) 2000-09-12 US disclosed
WO-1998005645-A9 4-SUBSTITUTED QUINOLINE DERIVATIVES HAVING FUNGICIDAL ACTIVITY 1998-08-20 WO disclosed