SCHEMBL4760730

SCHEMBL4760730

Fc1ccc2nc(-c3cccc4c3-c3ccccc3C4)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 9/20 0.53
METAP2 P50579 2/20 0.50
METAP1 P53582 2/20 0.50
CBFB Q13951 1/20 0.50
CYP11B1 P15538 1/20 0.46
AURKA O14965 1/20 0.45
KDR P35968 1/20 0.45
NPC1 O15118 2/20 0.43
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.43
PKM P14618 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
F7 P08709 1/20 0.43
TCF4 P15884 1/20 0.43
CTNNB1 P35222 1/20 0.43
BACE1 P56817 2/20 0.42
BACE2 Q9Y5Z0 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL4720946 0.85 CBFB (0.50) AMY1ACBFBAURKAKDRNPC1
SCHEMBL2308847 0.84 RAB9A (0.54) AMY1AKDRNPC1ALDH1A1RAB9A
SCHEMBL13658385 0.78 AMY1A (0.57) AMY1AMETAP2METAP1CBFBCYP11B1
SCHEMBL2315219 0.78 AMY1A (0.57) AMY1AMETAP2METAP1CBFBCYP11B1
SCHEMBL2309659 0.78 PDE5A (0.55) METAP2METAP1AURKAKDRNPC1
SCHEMBL4761477 0.78 FGFR1 (0.57) KDRNPC1ALDH1A1RAB9AKDM4E
SCHEMBL2317512 0.76 AMY1A (0.55) AMY1AMETAP2METAP1CBFBCYP11B1
SCHEMBL2317508 0.76 AMY1A (0.55) AMY1AMETAP2METAP1CBFBCYP11B1
SCHEMBL12431145 0.75 PDE5A (0.43) METAP2METAP1AURKAKDRNPC1
SCHEMBL2314913 0.75 AMY1A (0.51) AMY1AMETAP2METAP1CBFBCYP11B1

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-1888579-A2 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF Aventis Pharma S.A. (FR) 2008-02-20 EP disclosed
WO-2006123061-A2 FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA S.A. (FR) 2006-11-23 WO disclosed