SCHEMBL8548141

SCHEMBL8548141

Clc1ccc2c(NCCc3cccc(Oc4ccccc4)c3)ncnc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
HTT P42858 5/20 0.56
CNR1 P21554 2/20 0.55
CNR2 P34972 2/20 0.55
PIK3CD O00329 2/20 0.55
PIK3R1 P27986 2/20 0.55
LMNA P02545 2/20 0.54
APP P05067 2/20 0.54
EGFR P00533 1/20 0.54
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
RXFP1 Q9HBX9 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
PPARG P37231 1/20 0.49
NR2E3 Q9Y5X4 1/20 0.49
NCOR2 Q9Y618 1/20 0.49
NR2F2 P24468 1/20 0.49
MAPT P10636 1/20 0.48

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
SCHEMBL8548572 0.88 EGFR (0.71) MAPK1SMN1; SMN2HTTCNR1CNR2
SCHEMBL8975149 0.87 HTT (0.71) MAPK1SMN1; SMN2HTTCNR1CNR2
SCHEMBL7505545 0.83 CCNC (0.63) SMN1; SMN2HTTLMNAKDM4EALDH1A1
SCHEMBL8543093 0.81 HTT (0.49) MAPK1HTTCNR1CNR2PIK3CD
SCHEMBL8547638 0.80 MAPK1 (0.55) MAPK1SMN1; SMN2HTTCNR1CNR2
SCHEMBL9921509 0.78 PIK3CD (0.85) MAPK1HTTCNR1CNR2PIK3CD
SCHEMBL11846406 0.77 KDM4E (0.63) MAPK1SMN1; SMN2HTTPIK3CDPIK3R1
SCHEMBL8543007 0.77 HTT (0.77) MAPK1SMN1; SMN2HTTLMNAAPP
SCHEMBL15923256 0.76 EGFR (0.70) MAPK1SMN1; SMN2HTTLMNAAPP
SCHEMBL3979500 0.75 KDM4E (0.77) MAPK1SMN1; SMN2HTTCNR1CNR2

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