SCHEMBL22609552

SCHEMBL22609552

CC(C)(C)OC(=O)NCCOCCOCCCOC[C@@H](F)CN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.45
▸ AKT1 P31749 3/20 0.43
▸ ADRB2 P07550 2/20 0.41
▸ HTR1A P08908 2/20 0.41
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ BCHE P06276 2/20 0.39
▸ CNR2 P34972 2/20 0.39
▸ CTSS P25774 2/20 0.39
▸ CTSL P07711 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ TLR2 O60603 1/20 0.39
▸ TLR1 Q15399 1/20 0.39
▸ SIGMAR1 Q99720 2/20 0.38
▸ SUCNR1 Q9BXA5 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SYK P43405 1/20 0.37

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
SCHEMBL21071095 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21071107 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21070953 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL22609374 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21071364 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21070675 0.97 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21070300 0.95 IDO1 (0.43) IDO1AKT1CTSSCTSLCTSB
SCHEMBL21070267 0.95 IDO1 (0.49) IDO1AKT1ADRB2HTR1ALMNA
SCHEMBL21069213 0.91 IDO1 (0.43) IDO1AKT1TLR2TLR1SIGMAR1
SCHEMBL21070834 0.89 IDO1 (0.47) IDO1AKT1ADRB2HTR1ALMNA

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-3731869-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2020-11-04 — — EP disclosed
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