SCHEMBL11286630

SCHEMBL11286630

[CH2]COc1ccc(Oc2ncnc3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.56
NPC1 O15118 2/20 0.56
TSHR P16473 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
EGFR P00533 3/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
KDR P35968 4/20 0.47
PDGFRB P09619 2/20 0.47
FLT4 P35916 2/20 0.47
RAF1 P04049 1/20 0.47
KIT P10721 1/20 0.47
FLT1 P17948 1/20 0.47
LMNA P02545 1/20 0.46
BRAF P15056 1/20 0.45
MAPK14 Q16539 1/20 0.45
TNNI3K Q59H18 1/20 0.45
TEK Q02763 1/20 0.44
CSF1R P07333 5/20 0.41

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
SCHEMBL3979754 0.83 EGFR (0.69) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL1387173 0.82 EGFR (0.61) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL3106181 0.81 EGFR (0.57) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL3977060 0.81 EGFR (0.57) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL8200916 0.81 EGFR (0.57) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL3980790 0.80 EGFR (0.54) RAB9ANPC1TSHRL3MBTL1EGFR
Hydrochloric Acid SCHEMBL4731344 0.79 EGFR (0.56) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL3635988 0.79 EGFR (0.62) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL17508505 0.77 EGFR (0.54) RAB9ANPC1TSHRL3MBTL1EGFR
SCHEMBL4078517 0.77 KDR (0.61) RAB9ANPC1TSHRL3MBTL1EGFR

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-0044163-A2 Quinazolinyloxy(amino)phenoxyalkane carboxylic acid derivatives, process for their synthesis, herbicidal compositions containing them and their use as herbicides ICI AUSTRALIA LIMITED (AU) 1982-01-20 EP disclosed