SCHEMBL28548490

SCHEMBL28548490

COOC(=O)C(OC)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
RECQL P46063 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
SCHEMBL276322 0.79 KMT2A (0.43) SLC1A3SLC1A2SLC1A1KMT2AALDH1A1
SCHEMBL1427169 0.78
SCHEMBL170213 0.75 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL27699995 0.75 SOAT1 (0.31)
SCHEMBL27968726 0.73 TSHR (0.40) SLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL4755149 0.73 ALDH1A1 (0.42) SLC1A3SLC1A2SLC1A1KMT2AALDH1A1
SCHEMBL11685073 0.73 SLC1A3 (0.33) SLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL24725871 0.72 TP53 (0.36) SLC1A3SLC1A2SLC1A1KMT2AALDH1A1
Water SCHEMBL11684198 0.71 SLC1A3 (0.32) SLC1A3SLC1A2SLC1A1
SCHEMBL25204323 0.71 DGAT1 (0.37) SLC1A3SLC1A2SLC1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108440394-B Fullerene electron transport layer material and perovskite solar cell formed by same 浙江大学 2021-04-27 CN disclosed