SCHEMBL10650996

SCHEMBL10650996

CCOC(=O)CN1C(=O)CSc2ccc(F)cc21

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.70
LMNA P02545 4/20 0.59
POLB P06746 1/20 0.51
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 1/20 0.46
USP2 O75604 1/20 0.45
HTT P42858 1/20 0.45
PPARG P37231 1/20 0.45
PKM P14618 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL10650186 0.91 NPSR1 (0.70) NPSR1LMNAPOLBMAPTUSP2
SCHEMBL10652360 0.87 NPSR1 (0.53) NPSR1LMNAPOLBMAPTUSP2
SCHEMBL10651949 0.86 LMNA (0.79) NPSR1LMNAPOLBMAPTTDP1
SCHEMBL10649175 0.85 NPSR1 (0.66) NPSR1LMNAPOLBMAPTTDP1
SCHEMBL10653275 0.85 NPSR1 (0.69) NPSR1LMNAPOLBMAPTTDP1
SCHEMBL7562796 0.83 NPSR1 (1.00) NPSR1LMNAPOLBMAPTKMT2A
SCHEMBL30808596 0.82 ALDH1A1 (0.48) NPSR1LMNAPOLBMAPTTP53
SCHEMBL10649933 0.82 ALDH1A1 (0.48) NPSR1LMNAPOLBMAPTTP53
SCHEMBL10651710 0.81 NPSR1 (0.66) NPSR1LMNAPOLBMAPTTDP1
SCHEMBL8264586 0.80 NPSR1 (0.62) NPSR1LMNAPOLBMAPTTDP1

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
US-4755509-A Heterocyclic aldose reductase inhibitors and methods of using them Carbipem (FR) 1988-07-05 US disclosed