SCHEMBL5247396

SCHEMBL5247396

O=C(O)c1cc2ccccc2n1-c1ccc2ccccc2c1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.76
▸ TSHR P16473 1/20 0.76
▸ PLA2G10 O15496 7/20 0.57
▸ DAO P14920 1/20 0.56
▸ MCL1 Q07820 1/20 0.54
▸ CCR2 P41597 4/20 0.49
▸ LDHA P00338 1/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ HAO1 Q9UJM8 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.41
▸ FDPS P14324 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
SCHEMBL5208338 0.86 ALDH1A1 (1.00) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL30194196 0.86 ALDH1A1 (1.00) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL28916206 0.83 ALDH1A1 (0.54) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL31689667 0.83 ALDH1A1 (0.54) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL21822179 0.83 ALDH1A1 (0.54) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL9260948 0.83 ALDH1A1 (0.79) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL9149430 0.83 ALDH1A1 (0.79) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL5421995 0.83 ALDH1A1 (0.79) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL3957422 0.83 ALDH1A1 (0.79) ALDH1A1TSHRPLA2G10DAOMCL1
SCHEMBL21822442 0.82 ALDH1A1 (0.52) ALDH1A1TSHRPLA2G10DAOMCL1

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-1778632-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 — — EP disclosed
WO-2005123673-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 — — WO disclosed
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