SCHEMBL7983380

SCHEMBL7983380

COC(=O)Oc1ccc(Cl)nn1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
NNMT P40261 1/20 0.38
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.34
PANK3 Q9H999 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL7994150 0.81 KMT2A (0.42) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL6968314 0.79 LMNA (0.45) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL4039966 0.79 LMNA (0.41) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL15881082 0.77 ALDH1A1 (0.41) KMT2ALMNAMEN1SMN1; SMN2ALDH1A1
SCHEMBL321951 0.75
SCHEMBL29862129 0.75
SCHEMBL2547519 0.75 LMNA (0.51) KMT2ALMNAMEN1SMN1; SMN2MAPT
SCHEMBL9326030 0.73 L3MBTL1 (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1GAA
SCHEMBL8459579 0.73 PTK2 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7963225 0.71 CA12 (0.38) KMT2AMEN1ALDH1A1MAPTNNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367827-B1 3-(3-PYRIMIDINE-2-YL-BENZYL)-[1,2,4]TRIAZOLO [4,3-b]PYRIDAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-02-27 EP disclosed
WO-2001007416-A1 METHOD OF PRODUCING PYRIDAZINE CARBOXYLIC ACID DERIVATIVES LONZA AG (CH) 2001-02-01 WO disclosed