SCHEMBL17907443

SCHEMBL17907443

Cc1ccc(C)c(-c2ccc(C(N)=O)cc2C(N)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.47
S1PR4 O95977 1/20 0.46
ALDH1A1 P00352 2/20 0.43
SLC9A1 P19634 2/20 0.40
MAPK14 Q16539 1/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
JAK2 O60674 1/20 0.39
BTK Q06187 2/20 0.38
MAPK1 P28482 1/20 0.38
MAP2K4 P45985 1/20 0.38
MAPKAPK2 P49137 1/20 0.38
MAPKAPK3 Q16644 1/20 0.38
MAPK6 Q16659 1/20 0.38
MAPKAPK5 Q8IW41 1/20 0.38
HSD11B1 P28845 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
SCHEMBL17907470 0.87 S1PR4 (0.49) PARP1S1PR4ALDH1A1SLC9A1MAPK14
SCHEMBL17009620 0.80 BCAT2 (0.50) PARP1S1PR4ALDH1A1SLC9A1HPGD
SCHEMBL6825758 0.79 PARP1 (0.50) PARP1ALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL4211451 0.77 PARP1 (0.50) PARP1MEN1KMT2AHSD11B1
SCHEMBL2784443 0.75 SLC9A1 (0.38) PARP1S1PR4ALDH1A1SLC9A1HPGD
SCHEMBL5608689 0.74 PARP1 (0.47) PARP1MEN1KMT2ABTK
SCHEMBL5679029 0.74 PARP1 (0.50) PARP1ALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL284479 0.73 MKNK1 (0.49) PARP1ALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL2128609 0.73 PARP1 (0.52) PARP1ALDH1A1SMN1; SMN2NNMTCA1
SCHEMBL9541786 0.73 PARP1 (0.52) PARP1ALDH1A1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11254082-B2 Multi-layer tube UBE INDUSTRIES, LTD. (JP) 2022-02-22 US disclosed
US-10663092-B2 Multilayer tube UBE INDUSTRIES, LTD. (JP) 2020-05-26 US disclosed
EP-3042758-B1 LAMINATED TUBE UBE INDUSTRIES (JP) 2020-05-06 EP disclosed
EP-3461631-A1 MULTILAYER TUBE Ube Industries, Ltd. (JP) 2019-04-03 EP disclosed
EP-3192650-B1 LAYERED TUBE UBE INDUSTRIES (JP) 2019-01-23 EP disclosed
US-20170261133-A1 MULTILAYER TUBE UBE INDUSTRIES, LTD. (JP) 2017-09-14 US disclosed
EP-3192650-A1 LAYERED TUBE UBE Industries, Ltd. (JP) 2017-07-19 EP disclosed
US-20160214343-A1 MULTI-LAYER TUBE UBE INDUSTRIES, LTD. (JP) 2016-07-28 US disclosed
EP-3042758-A1 LAMINATED TUBE UBE Industries, Ltd. (JP) 2016-07-13 EP disclosed