SCHEMBL19980271

SCHEMBL19980271

CC/C(C)=C(/C=C(/Cc1ccccc1)OC)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 1/20 0.36
NPC1 O15118 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
AKR1B1 P15121 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL20344473 0.83 CES1 (0.39) ALDH1A1SMN1; SMN2CES2CES1AKR1B1
SCHEMBL20344645 0.81 CYP2C9 (0.38) CNR2ALDH1A1SMN1; SMN2MAPTL3MBTL1
SCHEMBL21157019 0.78 ALDH1A1 (0.38) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL19980208 0.77 ALDH1A1 (0.40) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL12591107 0.75 CES2 (0.45) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL7298652 0.73 ALDH1A1 (0.44) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL7298648 0.73 ALDH1A1 (0.44) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL20344567 0.73 KCNN4 (0.35) ALDH1A1KDM4ELMNASMN1; SMN2MAPT
SCHEMBL20344562 0.71 ALDH1A1 (0.42) CNR2ALDH1A1KDM4ELMNARAB9A
SCHEMBL23188915 0.69 TSHR (0.45) CNR2ALDH1A1KDM4ELMNARAB9A

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-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 EP disclosed
EP-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 EP disclosed
EP-3508484-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-07-10 EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 EP disclosed