SCHEMBL7090364

SCHEMBL7090364

CC(C)n1nc(-c2cc(C(=O)N3CCCCCC3)nn2-c2ccccc2)ccc1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 11/20 0.48
MALT1 Q9UDY8 1/20 0.47
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
ALDH1A1 P00352 3/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CREBBP Q92793 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
CHRNA7 P36544 1/20 0.41
TSHR P16473 1/20 0.41
PTGS2 P35354 2/20 0.41
RPA1 P27694 1/20 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
SCHEMBL6988945 0.99 MGLL (0.49) MGLLMALT1CNR1CNR2ALDH1A1
SCHEMBL6986647 0.91 MGLL (0.50) MGLLMALT1PTGS2RPA1
SCHEMBL6986823 0.91 MGLL (0.60) MGLLMALT1ALDH1A1LMNAHPGD
SCHEMBL6988238 0.85 MGLL (0.51) MGLLALDH1A1LMNAHPGDNPSR1
SCHEMBL6988584 0.79 USP2 (0.43) MGLLALDH1A1USP2LMNAPOLB
SCHEMBL6986371 0.78 ALDH1A1 (0.41) ALDH1A1POLBMAPK1KMT2ATSHR
SCHEMBL6986113 0.77 AGTR2 (0.41) MGLLALDH1A1USP2LMNASMN1; SMN2
SCHEMBL6987355 0.76 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2MEN1MAPTMAPK1
SCHEMBL6981026 0.75 AGTR2 (0.40) MGLLALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL6987526 0.75 SIGMAR1 (0.47)

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-1313733-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP disclosed
WO-2002018382-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-07 WO disclosed