SCHEMBL28004161

SCHEMBL28004161

CC(=O)Nc1cccc2ccc(C=O)nc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.50
▸ MAPT P10636 5/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ PFKFB3 Q16875 1/20 0.45
▸ FGFR4 P22455 1/20 0.44
▸ MAPKAPK2 P49137 1/20 0.44
▸ SLC40A1 Q9NP59 1/20 0.43
▸ PLAU P00749 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ PDE10A Q9Y233 1/20 0.42

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
SCHEMBL14486096 0.86 CCR1 (0.52) CCR1MAPTKDM4EALDH1A1PFKFB3
SCHEMBL14551175 0.81 PLAU (0.46) CCR1MAPTPFKFB3FGFR4MAPKAPK2
SCHEMBL4711326 0.80 MAPT (0.63) MAPTALDH1A1SLC40A1GAATDP1
SCHEMBL20838479 0.78 CCR1 (0.42) CCR1MAPTKDM4EALDH1A1FGFR4
SCHEMBL11376092 0.77 CASP6 (0.49) MAPTKDM4EALDH1A1HPGDSLC40A1
SCHEMBL21912002 0.76 CCR1 (0.55) CCR1MAPTKDM4EALDH1A1HPGD
SCHEMBL26056685 0.76 GLO1 (0.66) CCR1KDM4ESLC40A1GAATDP1
SCHEMBL29950686 0.75 RXFP1 (0.50) CCR1MAPTKDM4EALDH1A1HPGD
SCHEMBL20838469 0.75 PTPN5 (0.46) CCR1MAPTALDH1A1FGFR4MAPKAPK2
SCHEMBL20838514 0.75 CCR1 (0.49) CCR1MAPTKDM4EALDH1A1FGFR4

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
CN-103409135-B Rhodamine fluorescent molecular probe using quinoline derivative as identification group and synthesis method thereof UNIV QIQIHAR 2015-02-25 — — CN disclosed
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