SCHEMBL7996072

SCHEMBL7996072

Cc1nc(-c2ccc(CN3CCN(S(=O)(=O)c4ccc5ccccc5c4)CC3=O)cc2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 2/20 0.46
PKM P14618 6/20 0.44
HTT P42858 1/20 0.44
TP53 P04637 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 5/20 0.43
GAA P10253 1/20 0.43
F10 P00742 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7996147 0.94 LMNA (0.42) LMNASMN1; SMN2KDM4EPKMHTT
SCHEMBL7996075 0.92 F10 (0.48) LMNASMN1; SMN2PKMHTTTP53
SCHEMBL7997639 0.91 L3MBTL1 (0.45) LMNASMN1; SMN2PKMTP53ALDH1A1
SCHEMBL7997760 0.91 MAPT (0.47) LMNASMN1; SMN2KDM4EPKMHTT
SCHEMBL8003134 0.91 MAPT (0.48) LMNASMN1; SMN2KDM4EPKMTP53
SCHEMBL7999821 0.89 F10 (0.48) LMNASMN1; SMN2PKMHTTTP53
SCHEMBL7996216 0.89 LMNA (0.46) LMNASMN1; SMN2KDM4ETP53ALDH1A1
SCHEMBL7986759 0.88 MAPT (0.42) LMNASMN1; SMN2PKMTP53ALDH1A1
SCHEMBL7999738 0.86 F10 (0.47) LMNASMN1; SMN2TP53MAPTF10
SCHEMBL7074071 0.86 KDM4E (0.56) LMNASMN1; SMN2KDM4EPKMHTT

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
WO-2000008005-A2 PIPERAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2000-02-17 WO disclosed