SCHEMBL5089992

SCHEMBL5089992

C=CN[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.55
NAALAD2 Q9Y3Q0 3/20 0.55
RIMKLA Q8IXN7 1/20 0.55
GGH Q92820 1/20 0.47
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
BLM P54132 1/20 0.45
SLC6A3 Q01959 1/20 0.45
MEN1 O00255 1/20 0.45
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
TET2 Q6N021 3/20 0.41
KDM4A O75164 2/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM2A Q9Y2K7 2/20 0.41
TET3 O43151 1/20 0.41
CYP1A2 P05177 2/20 0.40

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
SCHEMBL5089988 1.00 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGHSLC6A2
D-Glutamate SCHEMBL2471979 0.89 GRM8 (0.60) FOLH1NAALAD2RIMKLAGGHSLC6A2
SCHEMBL18680610 0.84 KMT2A (0.45) FOLH1NAALAD2RIMKLASLC6A2SLC6A4
SCHEMBL15935963 0.81 FOLH1 (0.57) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL702004 0.81 FOLH1 (0.57) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL8918081 0.81 TGFBR1 (0.34) FOLH1NAALAD2RIMKLA
SCHEMBL702003 0.81 FOLH1 (0.57) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL188480 0.79 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGHTET2
SCHEMBL15320713 0.79 FOLH1 (0.36) FOLH1NAALAD2RIMKLABLMNFKB1
SCHEMBL29123177 0.79 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGHTET2

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
US-20080197324-A1 OPHTHALMIC COMPOSITION CONTAINING A POLYOL-ACID COPOLYMER BAUSCH & LOMB INCORPORATED 2008-08-21 US claimed
CN-119219841-A Hydrogel material with similar skin mechanical properties and preparation method thereof 深圳百变天使科技有限公司 2024-12-31 CN disclosed