SCHEMBL11115589

SCHEMBL11115589

Cc1ccc(COC(=O)Nc2ccc(-c3ccc(=O)[nH]n3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ROCK2 O75116 1/20 0.48
MAPT P10636 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
JAK2 O60674 1/20 0.44
NTRK1 P04629 1/20 0.44
RET P07949 1/20 0.44
PDGFRB P09619 1/20 0.44
CDK8 P49336 1/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44
AURKB Q96GD4 1/20 0.44
NAMPT P43490 1/20 0.44
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
KDR P35968 1/20 0.43

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
SCHEMBL11116531 0.89 MEN1 (0.54) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11114617 0.89 KDR (0.48) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11119482 0.88 ROCK2 (0.62) ROCK2MAPTJAK2NTRK1RET
SCHEMBL11116880 0.86 LMNA (0.54) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL11116691 0.85 ALDH1A1 (0.45) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11116431 0.81 SMN1; SMN2 (0.51) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11115815 0.81 LMNA (0.50) LMNAROCK2MAPTNPC1RAB9A
SCHEMBL11123381 0.81 KDR (0.51) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11117088 0.81 PDGFRB (0.48) LMNAMEN1KMT2AROCK2MAPT
SCHEMBL11117644 0.80 LMNA (0.59) LMNAMEN1KMT2AMAPTNPC1

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-0116853-A1 Pyridazinones, processes for preparing them, therapeutical compositions containing these compounds and their use BASF Aktiengesellschaft (DE) 1984-08-29 EP disclosed