SCHEMBL10768004

SCHEMBL10768004

O=C(Nc1ccc(CCc2ccc(O)c(O)c2)cc1)C(=O)c1sc2ccc(Cl)cc2c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 11/20 0.55
▸ ERCC1 P07992 1/20 0.45
▸ ERCC4 Q92889 1/20 0.45
▸ AKR1B1 P15121 1/20 0.42
▸ IGF1R P08069 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GABRP O00591 1/20 0.40
▸ GABRD O14764 1/20 0.40
▸ GABRA1 P14867 1/20 0.40
▸ GABRB1 P18505 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA5 P31644 1/20 0.40
▸ GABRA3 P34903 1/20 0.40
▸ GABRA2 P47869 1/20 0.40
▸ GABRB2 P47870 1/20 0.40
▸ GABRA4 P48169 1/20 0.40
▸ GABRE P78334 1/20 0.40
▸ GABRA6 Q16445 1/20 0.40
▸ GABRG1 Q8N1C3 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
SCHEMBL10412027 0.87 ALOX15 (0.54) ALOX15ERCC1ERCC4MAPTCCR5
SCHEMBL10412088 0.72 MAPT (0.56) MAPT
SCHEMBL10384347 0.71 ALOX15 (1.00) ALOX15ERCC1ERCC4
SCHEMBL9826484 0.69 ALOX15 (0.76) ALOX15CCR5
SCHEMBL10385051 0.68 ALOX15 (0.49) ALOX15ERCC1ERCC4MAPTCCR5
SCHEMBL27772533 0.67 ALOX15 (0.85) ALOX15AKR1B1IGF1RMAPT
SCHEMBL9826852 0.67 CNR1 (0.56) ALOX15MAPTGABRPGABRDGABRA1
SCHEMBL10481437 0.66 P2RX1 (0.53) MAPT
SCHEMBL10481468 0.66 LMNA (0.48) ALOX15MAPT
SCHEMBL10412487 0.65 ALOX15 (0.48) ALOX15MAPTCCR5

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-0221345-A1 Novel enolamides, process for their manufacture and pharmaceutical compositions thereof with an activity as modulators of the arachidonic acid cascade WARNER-LAMBERT COMPANY (US) 1987-05-13 — — EP disclosed
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