SCHEMBL1574400

SCHEMBL1574400

CC1CCN(C(=O)n2nc(O)c3cccnc32)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 0.44
ELANE P08246 7/20 0.44
KMT2A Q03164 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 1/20 0.43
FAAH O00519 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ACHE P22303 1/20 0.40
MGLL Q99685 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
SCHEMBL1573961 0.82 SMN1; SMN2 (0.39) KMT2ACYP1A2CYP2C19MEN1ALDH1A1
SCHEMBL1573842 0.82 ACHE (0.47) KMT2ACYP1A2CYP2C19MEN1ALDH1A1
SCHEMBL13246570 0.76 MGLL (0.65) KMT2ACYP1A2CYP2C19ALDH1A1CYP2C9
SCHEMBL18705459 0.73 ELANE (0.47) ELANE
SCHEMBL1573944 0.72 RAB9A (0.42) KMT2AALDH1A1NPSR1SMN1; SMN2ACHE
SCHEMBL1573858 0.72 MAPT (0.43) KMT2AMEN1ALDH1A1NPSR1SMN1; SMN2
SCHEMBL1573967 0.72 ACHE (0.44) ELANEKMT2ACYP1A2CYP2C19MEN1
SCHEMBL13246475 0.71 MGLL (0.62) KMT2AFAAHSMN1; SMN2ACHEMGLL
SCHEMBL1574081 0.70 ALDH1A1 (0.49) CTSBELANEKMT2ACYP1A2CYP2C19
SCHEMBL1148803 0.69 KMT2A (0.47) CTSBKMT2ACYP1A2CYP2C19MEN1

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-1713779-B1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-04-13 EP disclosed
CN-1914180-A Indazole derivatives as hormone sensitive lipase inhibitors SANOFI AVENTIS DEUTSCHLAND (DE) 2007-02-14 CN disclosed