SCHEMBL7904906

SCHEMBL7904906

O=C(O)N(C(=O)O)c1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
HSD17B10 Q99714 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
TSHR P16473 2/20 0.53
POLB P06746 1/20 0.50
LMNA P02545 2/20 0.48
NAPRT Q6XQN6 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TRPM8 Q7Z2W7 1/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 1/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL935444 0.83 HTT (0.54) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL23723906 0.81 RAB9A (0.54) KMT2AHSD17B10NPC1RAB9APOLB
SCHEMBL2954353 0.81 TSHR (0.51) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL1256530 0.81 KMT2A (0.53) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL15348824 0.79 TSHR (0.50) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL243741 0.79 POLB (0.51) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL19668416 0.79 TSHR (0.54) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL10855054 0.78 NPSR1 (0.50) KMT2AHSD17B10NPC1RAB9ATSHR
Hydrochloric Acid SCHEMBL11804810 0.78 POLB (0.50) KMT2AHSD17B10NPC1RAB9ATSHR
SCHEMBL174073 0.76 KMT2A (0.49) KMT2AHSD17B10NPC1RAB9ATSHR

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-1156371-A2 Replenishing method of planographic printing plate developer FUJI PHOTO FILM CO., LTD. (JP) 2001-11-21 EP disclosed