SCHEMBL8549790

SCHEMBL8549790

CC(C)Oc1cccc(CCOc2ncnc3ccccc23)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.54
NPC1 O15118 3/20 0.54
TSHR P16473 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
EGFR P00533 1/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.42
LMNA P02545 3/20 0.42
POLB P06746 1/20 0.41
KDR P35968 1/20 0.40
RXFP1 Q9HBX9 2/20 0.40
DHFR P00374 1/20 0.40
ATM Q13315 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL8547151 0.86 RAB9A (0.58) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8543820 0.84 RAB9A (0.62) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8542540 0.81 LMNA (0.55) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL9385472 0.79 RAB9A (0.52) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8548739 0.79 RAB9A (0.69) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8544270 0.79 RAB9A (0.57) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8547183 0.79 RAB9A (0.54) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8546082 0.79 RAB9A (0.54) RAB9ANPC1TSHRL3MBTL1CYP1A2
SCHEMBL8543120 0.77 RAB9A (0.58) RAB9ANPC1TSHRL3MBTL1CYP1A2
Hydrochloric Acid SCHEMBL27889646 0.77 RAB9A (0.49) RAB9ANPC1TSHRL3MBTL1CYP1A2

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