SCHEMBL25155585

SCHEMBL25155585

Cc1ccc(OC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 3/20 0.49
▸ GPR119 Q8TDV5 2/20 0.46
▸ LMNA P02545 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ FEN1 P39748 1/20 0.43
▸ CHEK2 O96017 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNB4 P30926 1/20 0.41
▸ CHRNA3 P32297 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ F2RL3 Q96RI0 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 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
SCHEMBL31360002 1.00 ALOX5AP (0.49) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL31360230 1.00 ALOX5AP (0.49) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL31360077 1.00 ALOX5AP (0.49) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL25155629 1.00 ALOX5AP (0.49) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL31360271 0.97 ALOX5AP (0.46) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL31360141 0.97 ALOX5AP (0.46) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL25156064 0.97 ALOX5AP (0.46) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL25156353 0.94 ALOX5AP (0.43) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL25155387 0.94 ALOX5AP (0.43) ALOX5APGPR119LMNANPSR1FEN1
SCHEMBL31360281 0.94 ALOX5AP (0.43) ALOX5APGPR119LMNANPSR1FEN1

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-2023064493-A1 COMPOUNDS AND METHODS FOR TREATING CORONAVIRUSES Clear Creek Bio, Inc. (US) 2023-04-20 — — WO disclosed
Send feedback