SCHEMBL6218698

SCHEMBL6218698

COc1c(-c2ccccc2)c(C(=O)c2cc[c]cc2)n2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.43
▸ HTT P42858 2/20 0.43
▸ TP53 P04637 1/20 0.41
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37

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
SCHEMBL6218948 0.84 HTT (0.51) MAPTHTTALDH1A1KDM4ENPC1
SCHEMBL3597910 0.79 MAPT (0.47) MAPTTP53NPC1GAA
SCHEMBL11186148 0.79 MAPT (0.41) MAPTHTTTP53PDE4APDE4B
SCHEMBL322335 0.76 MAPT (0.45) MAPTTP53ALDH1A1KDM4ELMNA
SCHEMBL3602590 0.74 NPC1 (0.40) MAPTHDAC1HDAC6ALDH1A1KDM4E
SCHEMBL27817268 0.74 SMN1; SMN2 (0.41) MAPTTP53PDE4APDE4BPDE4C
SCHEMBL1573132 0.73 MAPT (0.40) MAPTTP53PDE4APDE4BPDE4C
SCHEMBL145768 0.73 HTT (0.55) MAPTHTTALDH1A1KDM4ELMNA
SCHEMBL1572852 0.71 MAPT (0.42) MAPTTP53
SCHEMBL28115592 0.71 HTT (0.50) MAPTHTTTP53ALDH1A1NPC1

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-1495023-B1 NOVEL 1,2,3-SUBSTITUTED INDOLIZINE DERIVATIVES, INHIBITORS OF FGFS, METHOD FOR MAKING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI AVENTIS (FR) 2005-09-07 — — EP disclosed
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