SCHEMBL503694

SCHEMBL503694

C=C(C)C(=O)Oc1ccc(-c2cccc(C#N)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.47
SLC22A12 Q96S37 1/20 0.47
ELANE P08246 1/20 0.47
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
PTPN5 P54829 1/20 0.44
BACE1 P56817 2/20 0.43
ADAMTS4 O75173 1/20 0.43
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43
PGR P06401 2/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PIN1 Q13526 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA4 P48058 1/20 0.41
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41

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
SCHEMBL19608731 0.86 LMNA (0.60) XDHSLC22A12HRH2HRH1LMNA
SCHEMBL30763517 0.86 MMP2 (0.50) ELANELMNAMMP13MAPTMMP2
SCHEMBL2123965 0.85 ELANE (0.57) ELANELMNAGAAMAPTTDP1
SCHEMBL13762843 0.84 MGLL (0.50) ELANELMNA
SCHEMBL2122878 0.83 ELANE (0.54) ELANELMNAGAAMAPTTDP1
SCHEMBL447166 0.81 ELANE (0.54) ELANELMNAMAPTMMP2MMP3
SCHEMBL242192 0.79 ELANE (0.70) ELANELMNAGAAMAPTTDP1
SCHEMBL9183109 0.79 ELANE (0.70) ELANELMNAGAAMAPTTDP1
SCHEMBL803168 0.79 ELANE (0.62) ELANELMNAGAABACE1MAPT
SCHEMBL17433304 0.79 ELANE (0.62) ELANELMNAGAABACE1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117327362-A Curable resin composition 东京应化工业株式会社 2024-01-02 CN disclosed
US-20120026150-A1 DISPLAY ELEMENT AND ELECTICAL DEVICE SHARP KABUSHIKI KAISHA (JP) 2012-02-02 US disclosed