SCHEMBL8779339

SCHEMBL8779339

O=C(O)CNC(=O)Oc1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.45
FTO Q9C0B1 1/20 0.45
EGLN1 Q9GZT9 2/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
PSMB5 P28074 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 2/20 0.39
HPGD P15428 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ABAT P80404 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.38
EPHX1 P07099 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
P4HTM Q9NXG6 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL28522946 0.82 KDM4E (0.46) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL28592511 0.78 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9ALMNAGAA
SCHEMBL969754 0.78 TSHR (0.42) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL28440224 0.78 NPC1 (0.41) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL6629780 0.77 NPC1 (0.56) SMN1; SMN2NPC1RAB9ALMNAGAA
SCHEMBL25354801 0.76 NPC1 (0.40) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL1853707 0.76 P2RX7 (0.42) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL12052657 0.76 ALDH1A1 (0.49) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL4076740 0.76 EGLN1 (0.44) FTOEGLN1KMT2AMEN1EPHX1
SCHEMBL1833771 0.75 HSD17B10 (0.58) NPC1RAB9AGAAALOX15EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661269-B1 Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments HOECHST AG (DE) 1997-03-26 EP disclosed
EP-0650961-B1 Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments HOECHST AG (DE) 1997-03-05 EP disclosed
EP-0661269-A1 Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed
EP-0650961-A1 Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-03 EP disclosed