SCHEMBL9826580

SCHEMBL9826580

COc1ccnc(OC)n1.O=C(O)Nc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.44
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
ATM Q13315 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
SYK P43405 1/20 0.41
HTT P42858 2/20 0.40
NOTUM Q6P988 1/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CNR1 P21554 1/20 0.40
GAA P10253 1/20 0.40
GRM4 Q14833 1/20 0.40
KDR P35968 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL29520064 0.78 CCR1 (0.41) RAB9AL3MBTL1LMNA
SCHEMBL12015 0.78 CCR1 (0.41) RAB9AL3MBTL1LMNA
SCHEMBL28732675 0.76 KDR (0.50) ATRKCNK3KCNK9RAB9ANPC1
SCHEMBL27990718 0.76 CCR1 (0.40) RAB9AL3MBTL1LMNA
SCHEMBL21360044 0.74 TDP1 (0.38) RAB9AL3MBTL1LMNAPOLB
Boric Acid SCHEMBL29053153 0.74 TDP1 (0.38) RAB9ANPC1L3MBTL1SMN1; SMN2LMNA
SCHEMBL15880285 0.72 SORT1 (0.55) ATRKCNK3KCNK9KMT2AMEN1
SCHEMBL28115657 0.72 MTNR1A (0.36) RAB9AL3MBTL1LMNAPOLB
SCHEMBL13201041 0.71 LMNA (0.60) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL8620552 0.71 SMN1; SMN2 (0.56) RAB9ANPC1KMT2AMEN1SMN1; SMN2

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-0235449-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-09-11 EP disclosed