SCHEMBL28039478

SCHEMBL28039478

C=C(C(=O)OC)C(Cl)CC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TGFBR1 P36897 1/20 0.31
TET2 Q6N021 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL9745494 0.83 ALDH1A1 (0.41) ALDH1A1TGFBR1TET2EGLN1
SCHEMBL28519243 0.80 CA2 (0.43) ALDH1A1CA1CA2
SCHEMBL6042912 0.77 ALDH1A1 (0.44) ALDH1A1CA1CA2TGFBR1TET2
SCHEMBL7692054 0.77
SCHEMBL23581066 0.76 ALDH1A1 (0.42) ALDH1A1CA1CA2TGFBR1TET2
SCHEMBL4905915 0.76 ALDH1A1 (0.42) ALDH1A1CA1CA2TGFBR1TET2
SCHEMBL10959695 0.75
SCHEMBL6659311 0.75
SCHEMBL3293587 0.74 ALDH1A1 (0.41) ALDH1A1CA1CA2TGFBR1TET2
Ammonia Solution, Strong SCHEMBL27736662 0.74 ALDH1A1 (0.41) ALDH1A1CA1CA2TGFBR1TET2

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-105144435-A Conductive composition, conductive composition for forming base layer, collector with base layer for use in power storage device, electrode for use in power storage device, and power storage device TOYO INK SC HOLDINGS CO LTD 2015-12-09 CN disclosed
CN-105074978-A Conductive composition, collector with base layer for electricity storage devices, electrode for electricity storage devices, and electricity storage device TOYO INK SC HOLDINGS CO LTD 2015-11-18 CN disclosed