SCHEMBL14145271

SCHEMBL14145271

O=Cc1ccc(C(=O)NCc2cccnc2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.53
ALDH1A1 P00352 5/20 0.53
LMNA P02545 3/20 0.53
MAPK1 P28482 1/20 0.53
BLM P54132 1/20 0.53
RECQL P46063 1/20 0.52
HTT P42858 4/20 0.52
USP2 O75604 3/20 0.52
MMP13 P45452 1/20 0.52
KMT2A Q03164 2/20 0.52
TSHR P16473 4/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 1/20 0.51
CASP1 P29466 1/20 0.51
MAPK10 P53779 1/20 0.51
CASP7 P55210 1/20 0.51
TRPA1 O75762 1/20 0.50
PKM P14618 1/20 0.50
MAPT P10636 1/20 0.50
HSD17B10 Q99714 3/20 0.49

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
SCHEMBL14625755 0.84 NPSR1 (0.56) NPSR1ALDH1A1LMNAMAPK1BLM
SCHEMBL1588305 0.83 RECQL (0.60) NPSR1ALDH1A1LMNARECQLHTT
SCHEMBL12313834 0.80 HPGD (0.57) NPSR1ALDH1A1LMNAMAPK1RECQL
SCHEMBL1587643 0.80 GAA (0.58) NPSR1ALDH1A1LMNAMAPK1BLM
SCHEMBL4919514 0.79 ESRRG (0.58) NPSR1RECQLHTTUSP2MMP13
SCHEMBL12265879 0.79 LMNA (0.62) NPSR1ALDH1A1LMNAMAPK1BLM
SCHEMBL2229698 0.79 HDAC1 (0.72) NPSR1ALDH1A1LMNARECQLHTT
SCHEMBL14625757 0.76 HPGD (0.67) ALDH1A1LMNAHTTKMT2AHPGD
SCHEMBL4194312 0.76 VNN1 (0.62) NPSR1ALDH1A1LMNARECQLHTT
SCHEMBL3459320 0.76 NPSR1 (0.58) NPSR1ALDH1A1LMNARECQLHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1947101-A1 HYDRAZIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR Nissan Chemical Industries, Ltd. (JP) 2008-07-23 EP disclosed