Sugi Predict

Sugi Predict / Compounds / SCHEMBL14534809

SCHEMBL14534809

SCHEMBL14534809

NC(=O)N[C@H]1CCC[C@@H]1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MERTK Q12866 12/20 0.53
▸ AXL P30530 9/20 0.53
▸ P2RX7 Q99572 1/20 0.52
▸ MET P08581 1/20 0.52
▸ TYRO3 Q06418 1/20 0.52
▸ TACR1 P25103 2/20 0.50
▸ KCNA5 P22460 1/20 0.48
▸ PTGES O14684 2/20 0.47
▸ PTGS2 P35354 2/20 0.47

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
SCHEMBL2064031 0.97 KCNA5 (0.51) MERTKAXLP2RX7METTYRO3
SCHEMBL13324324 0.86 P2RX7 (0.52) MERTKAXLP2RX7METTYRO3
SCHEMBL12629181 0.86 P2RX7 (0.52) MERTKAXLP2RX7METTYRO3
SCHEMBL27701237 0.86 KCNA5 (0.53) MERTKAXLP2RX7METTYRO3
SCHEMBL4075331 0.84 P2RX7 (0.50) MERTKAXLP2RX7METTYRO3
SCHEMBL13302610 0.83 MERTK (0.49) MERTKAXLP2RX7METTYRO3
SCHEMBL8230913 0.81 KCNA5 (0.50) MERTKAXLP2RX7METTYRO3
SCHEMBL5435734 0.81 KMT2A (0.54) MERTKAXLP2RX7METTYRO3
SCHEMBL5645993 0.81 KMT2A (0.54) MERTKAXLP2RX7METTYRO3
SCHEMBL12734545 0.81 KMT2A (0.54) MERTKAXLP2RX7METTYRO3

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
WO-2007062314-A2 HETEROCYCLIC CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-31 — — WO disclosed