SCHEMBL20163227

SCHEMBL20163227

CSc1ccccc1C(O)C(C)(C)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.36
RECQL P46063 1/20 0.35
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
KDM4E B2RXH2 1/20 0.34
KCNA5 P22460 2/20 0.33
CYP3A4 P08684 1/20 0.33
HIF1A Q16665 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
ATM Q13315 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL4706933 0.74 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
SCHEMBL29618229 0.73 NPC1 (0.36) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
SCHEMBL29686523 0.70 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
SCHEMBL218736 0.70 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
SCHEMBL5964790 0.69 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
Hydrochloric Acid SCHEMBL27887610 0.67 MEN1 (0.43) ALDH1A1SMN1; SMN2TSHRGAAADRB2
SCHEMBL96865 0.66 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2TSHRMAPK1RAB9A
SCHEMBL19333365 0.66 CYP3A4 (0.41) ALDH1A1SMN1; SMN2MAPK1GAARAB9A
SCHEMBL7946126 0.65 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2TSHRMAPK1GAA
SCHEMBL7564918 0.65 PKM (0.40) ALDH1A1SMN1; SMN2TSHRMAPK1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108102540-B Hard coating composition and flexible display device including the same 三星显示有限公司 2021-08-13 CN disclosed
US-10793747-B2 Hard coating composition and flexible display device including the hard coating composition SAMSUNG DISPLAY CO., LTD. (KR) 2020-10-06 US disclosed
US-20180142127-A1 HARD COATING COMPOSITION AND FLEXIBLE DISPLAY DEVICE INCLUDING THE HARD COATING COMPOSITION Solip Tech Co., Ltd. (KR) 2018-05-24 US disclosed