SCHEMBL11290153

SCHEMBL11290153

COC(=O)c1cn(-c2ccccc2Cl)nc(C(=O)OC)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
PARP1 P09874 1/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BRD4 O60885 2/20 0.41
KMT2A Q03164 3/20 0.41
MYC P01106 1/20 0.40
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
F2 P00734 1/20 0.39
NR4A2 P43354 1/20 0.39
CA12 O43570 2/20 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
SCHEMBL718347 0.83 PARP1 (0.46) GAAPARP1MAPTALDH1A1MAPK1
SCHEMBL10712387 0.79 CA12 (0.59) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL10258872 0.72 MET (0.47) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL28748453 0.71 KMT2A (0.50) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL519514 0.71 PDE10A (0.53) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL70479 0.71 MAPT (0.69) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL28748461 0.69 ALDH1A1 (0.58) GAAALDH1A1MAPK1RAB9AKDM4E
SCHEMBL518611 0.68 NR1I2 (0.41) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL10258727 0.68 NR1I2 (0.41) GAAMAPTALDH1A1MAPK1NPC1
SCHEMBL13982921 0.67 PARP1 (0.52) PARP1ALDH1A1KDM4EALOX15SMN1; 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-0049971-A1 Substituted pyridazines, processes for making them, their use as plant growth regulators, and plant growth regulating compositions containing them ROHM AND HAAS COMPANY (US) 1982-04-21 EP disclosed