SCHEMBL721904

SCHEMBL721904

C[C@H](C(=O)O)[C@](O)(CC(=O)O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.59
CPT2 P23786 1/20 0.59
HSPD1 P10809 1/20 0.49
BLM P54132 1/20 0.49
HSPE1 P61604 1/20 0.49
ALDH1A1 P00352 1/20 0.42
HMGCR P04035 1/20 0.42
CHRM1 P11229 1/20 0.42
TBXA2R P21731 1/20 0.42
ADRA1A P35348 1/20 0.42
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
CYP1A2 P05177 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL17610129 1.00 ACLY (0.59) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL271213 1.00 ACLY (0.59) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL28318764 0.98 ACLY (0.57) ACLYCPT2HSPD1BLMHSPE1
Propionic Acid SCHEMBL30531141 0.94 CPT2 (0.53) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL9397465 0.85 ACLY (0.53) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL18437564 0.85 CPT2 (0.48) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL14417550 0.84 ACLY (0.52) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL59972 0.81 ACLY (0.58) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL1409965 0.81 ACLY (0.58) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL1462468 0.81 ACLY (0.58) ACLYCPT2HSPD1BLMHSPE1

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
US-20120048295-A1 CLEANING FORMULATION FOR REMOVING RESIDUES ON SURFACES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2012-03-01 US disclosed