SCHEMBL21332745

SCHEMBL21332745

O=C(O)c1nc2ccccc2n1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.50
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 5/20 0.45
RECQL P46063 2/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 2/20 0.44
MAPT P10636 3/20 0.44
PKM P14618 3/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 2/20 0.43
ASAH1 Q13510 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NOD1 Q9Y239 1/20 0.42
HSD17B10 Q99714 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 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
SCHEMBL843331 0.86 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL23855754 0.81 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL2461861 0.81 RAB9A (0.53) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL7645 0.79 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL28012191 0.78 NPC1 (0.50) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL760729 0.78 SMN1; SMN2 (0.57) SMN1; SMN2NPC1RAB9AALDH1A1KDM4E
SCHEMBL27945131 0.78 KMT2A (0.68) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL28012189 0.78 KDM4E (0.49) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL28976493 0.78 NPC1 (0.50) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL6961424 0.78 NOS2 (0.53) SMN1; SMN2NPC1RAB9AKMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3762463-A1 LOW HAZE POLYIMIDE FILM DuPont Electronics, Inc. (US) 2021-01-13 EP disclosed
WO-2019173301-A1 LOW HAZE POLYIMIDE FILM E. I. DU PONT DE NEMOURS AND COMPANY (US) 2019-09-12 WO disclosed