SCHEMBL8548719

SCHEMBL8548719

Fc1ccccc1Oc1ccc(CCOc2ncnc3c(F)cccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 6/20 0.40
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
LPAR1 Q92633 3/20 0.38
LPAR5 Q9H1C0 3/20 0.38
KDM4E B2RXH2 1/20 0.38
AURKA O14965 1/20 0.37
RPS6KB1 P23443 1/20 0.37
DAO P14920 1/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ESR1 P03372 1/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PARP10 Q53GL7 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL8547249 0.91 AURKA (0.45) LMNAPOLBAURKARPS6KB1RAB9A
SCHEMBL8543212 0.87 RAB9A (0.51) MRGPRX1LMNAPOLBLPAR1LPAR5
SCHEMBL9383256 0.86 TRPA1 (0.39) LMNAPOLBKDM4EAURKARPS6KB1
SCHEMBL8548684 0.85 RAB9A (0.42) LMNAPOLBKDM4EAURKARPS6KB1
SCHEMBL8548239 0.85 AURKA (0.44) KDM4EAURKARPS6KB1RAB9AALDH1A1
SCHEMBL8542280 0.84 AURKA (0.47) POLBKDM4EAURKARPS6KB1RAB9A
SCHEMBL9389676 0.84 AURKA (0.41) AURKARPS6KB1
SCHEMBL8543586 0.83 RAB9A (0.51) LMNAPOLBKDM4EAURKARPS6KB1
SCHEMBL8548285 0.83 GABRA1 (0.39) LMNAPOLBKDM4EAURKARPS6KB1
SCHEMBL9469206 0.82 AURKA (0.42) LMNAPOLBAURKARPS6KB1RAB9A

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
EP-0326329-B1 Quinazoline derivatives useful as insecticides. DOW AGROSCIENCES LLC (US) 1998-10-28 EP disclosed