SCHEMBL2363002

SCHEMBL2363002

C=CCOC(=O)C(O)C(O)C(=O)[O-].C=CCOC(=O)C(O)C(O)C(=O)[O-].[Pb+2]

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 3/20 0.34
MAPT P10636 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
HTT P42858 1/20 0.33
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 2/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31

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
SCHEMBL167949 0.87 CYP3A4 (0.43) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL167950 0.83 TSHR (0.43) CYP3A4TDP1TSHRMAPTCACNA1B
Ammonia Solution, Strong SCHEMBL28223082 0.83 CYP3A4 (0.41) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL2363000 0.82 TSHR (0.42) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL17338689 0.76 PDE4A (0.42) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL27669919 0.76 PDE4A (0.42) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL7580766 0.75 TDP1 (0.44) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL12191482 0.75 TDP1 (0.44) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL2497807 0.75 TDP1 (0.44) CYP3A4TDP1TSHRMAPTCACNA1B
SCHEMBL18175956 0.74 TSHR (0.44) CYP3A4TDP1TSHRMAPTCACNA1B

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
WO-2011101258-A3 COSMETIC PREPARATIONS HAVING IMPROVED UV PROTECTION PERFORMANCE BEIERSDORF AG (DE) 2012-11-15 WO disclosed
WO-2011101258-A2 COSMETIC PREPARATIONS HAVING IMPROVED UV PROTECTION PERFORMANCE BEIERSDORF AG (DE) 2011-08-25 WO disclosed