SCHEMBL6091530

SCHEMBL6091530

Cc1cc(C=C2C(=O)NN=C2OC(C)C)[nH]c1C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.36
KDR P35968 4/20 0.33
TLK2 Q86UE8 2/20 0.32

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
SCHEMBL6091525 1.00 LRRK2 (0.36) LRRK2KDRTLK2
SCHEMBL6087969 0.82 LRRK2 (0.32) LRRK2
SCHEMBL6091251 0.80 PDPK1 (0.40) LRRK2KDRTLK2
SCHEMBL6091255 0.80 PDPK1 (0.40) LRRK2KDRTLK2
SCHEMBL6089020 0.79 PDPK1 (0.41) LRRK2TLK2
SCHEMBL6089634 0.79 KDR (0.55) KDRTLK2
SCHEMBL6089018 0.79 PDPK1 (0.41) LRRK2TLK2
SCHEMBL6089627 0.79 KDR (0.55) KDRTLK2
SCHEMBL6089676 0.78 SIRT1 (0.46) LRRK2
SCHEMBL6089672 0.78 SIRT1 (0.46) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP claimed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO claimed
US-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed
EP-1218373-A2 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2002-07-03 EP disclosed
WO-2001009121-A2 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-02-08 WO disclosed