SCHEMBL7477529

SCHEMBL7477529

COC(=O)c1c(C=O)c(C)c(C)n1CC1CC1C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
ALDH1A1 P00352 1/20 0.31
PARG Q86W56 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL5237222 1.00 LMNA (0.31) LMNAMAPTNPSR1ALDH1A1PARG
SCHEMBL5237232 1.00 LMNA (0.31) LMNAMAPTNPSR1ALDH1A1PARG
SCHEMBL7486844 0.88 LMNA (0.40) LMNAMAPTNPSR1ALDH1A1HTT
SCHEMBL7476209 0.84 NOTUM (0.38) LMNAMAPTNPSR1ALDH1A1HTT
SCHEMBL7475441 0.81 MAPK8 (0.40) LMNAMAPTALDH1A1
SCHEMBL7485767 0.76 LMNA (0.32) LMNAMAPTNPSR1ALDH1A1HTT
SCHEMBL7483009 0.76 ALDH1A1 (0.34) LMNAMAPTNPSR1ALDH1A1HTT
SCHEMBL7479670 0.75 MEN1 (0.36) LMNAMAPTNPSR1ALDH1A1HTT
SCHEMBL7482378 0.75 ALDH1A1 (0.37) LMNAMAPTNPSR1ALDH1A1
SCHEMBL7475018 0.75 KDM4E (0.32) LMNAMAPTNPSR1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742218-B1 PYRROLOPYRIDAZINE DERIVATIVE SANKYO CO (JP) 2002-12-04 EP disclosed
US-6063782-A Pyrrolopyridazine derivatives SANKYO COMPANY, LIMITED (JP) 2000-05-16 US disclosed
EP-0742218-A1 PYRROLOPYRIDAZINE DERIVATIVE SANKYO COMPANY LIMITED (JP) 1996-11-13 EP disclosed