SCHEMBL17873261

SCHEMBL17873261

CC(C)(C)OC(=O)Nc1cccc2c1COC2

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.41
EPHX2 P34913 1/20 0.40
GAA P10253 1/20 0.39
METAP1 P53582 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
BRD9 Q9H8M2 1/20 0.37
DRD2 P14416 3/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
LIPE Q05469 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
NAMPT P43490 1/20 0.36
NR1I3 Q14994 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36

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
SCHEMBL25144741 0.82 ALDH1A1 (0.55) LMNAPOLB
SCHEMBL30060774 0.81 ALDH1A1 (0.47) RXFP1METAP1LMNAPOLBDRD2
SCHEMBL23385619 0.81 ALDH1A1 (0.47) RXFP1METAP1LMNAPOLBDRD2
SCHEMBL23334164 0.79 ALDH1A1 (0.58) LMNAPOLB
SCHEMBL31182208 0.78 AAK1 (0.40) RXFP1GAAMETAP1NPC1RAB9A
SCHEMBL17873258 0.78 AAK1 (0.40) RXFP1GAAMETAP1NPC1RAB9A
SCHEMBL25909307 0.78 GAA (0.39) RXFP1GAAMETAP1LMNAPOLB
SCHEMBL28167978 0.78 GAA (0.39) RXFP1GAAMETAP1LMNAPOLB
SCHEMBL8058887 0.78 RXFP1 (0.44) RXFP1EPHX2METAP1LMNAPOLB
SCHEMBL23059536 0.77 TRPV1 (0.51)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4663626-A1 IMINE COMPOUNDS AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF Bio Genuine (Shanghai) Biotech Co., Ltd (CN) 2025-12-17 EP disclosed
WO-2024165071-A1 IMINE COMPOUNDS AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF 上海葆正医药科技有限公司 2024-08-15 WO disclosed
CN-107108596-B Oxazoline compounds substituted by fused ring systems 巴斯夫欧洲公司 2021-01-12 CN disclosed
EP-3237410-A1 AZOLINE COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM BASF SE (DE) 2017-11-01 EP disclosed
WO-2016102482-A1 AZOLINE COMPOUNDS SUBSTITUTED BY A CONDENSED RING SYSTEM BASF SE (DE) 2016-06-30 WO disclosed