SCHEMBL9028261

SCHEMBL9028261

COC=C(C=O)C(=O)Oc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
HTR1A P08908 1/20 0.37
TDP1 Q9NUW8 3/20 0.37
ATM Q13315 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 2/20 0.35
RAD51 Q06609 1/20 0.35
CA4 P22748 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL3016344 0.82 MAPT (0.39) ELANETDP1ATML3MBTL1HSD17B10
SCHEMBL27848448 0.79 ELANE (0.44) ELANEHTR1ATDP1ATML3MBTL1
SCHEMBL28935655 0.77 ALDH1A1 (0.40) ELANEHTR1ATDP1ATML3MBTL1
SCHEMBL6262232 0.76 ELANE (0.38) ELANEHTR1ATDP1ATML3MBTL1
SCHEMBL4405818 0.76 ELANE (0.45) ELANETDP1L3MBTL1HPGDALDH1A1
SCHEMBL29044269 0.76 ELANE (0.38) ELANEHTR1ATDP1ATML3MBTL1
SCHEMBL8646599 0.73 ALOX15 (0.50) HSD17B10HPGDALOX15ALDH1A1MAPT
SCHEMBL9296120 0.73 GAA (0.47) ALDH1A1MAPTGAAHTTSMN1; SMN2
SCHEMBL6463471 0.73 ATM (0.40) ELANEHTR1ATDP1ATML3MBTL1
SCHEMBL9028297 0.72 ELANE (0.36) ELANEHTR1ATDP1ATML3MBTL1

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
EP-0544587-B1 Alpha-methylene-2-vinyl-benzeneacetic acid derivatives, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1996-05-29 EP disclosed
WO-1995030639-A1 NOVEL β-METHOXY ACRYLIC ACID DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO S.A. (FR) 1995-11-16 WO disclosed
EP-0544587-A1 Alpha-methylene-2-vinyl-benzeneacetic acid derivatives, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1993-06-02 EP disclosed