SCHEMBL10442736

SCHEMBL10442736

CC(=O)c1ccc(OP(=O)(O)O)c(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 10/20 0.46
INPP5A Q14642 5/20 0.46
AKT1 P31749 1/20 0.46
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 2/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.42
PDE3A Q14432 1/20 0.42
INPP5B P32019 2/20 0.41
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
ABCC3 O15438 1/20 0.35
PLIN1 O60240 1/20 0.35
TP53 P04637 1/20 0.35
GSTA1 P08263 1/20 0.35
GSTP1 P09211 1/20 0.35
HSPD1 P10809 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL10442297 0.80 THRB (0.48) INPPL1INPP5AAKT1ALDH1A1KDM4E
SCHEMBL6136937 0.78 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10HPGDLMNA
SCHEMBL258268 0.76 INPPL1 (0.54) INPPL1INPP5AAKT1ALDH1A1KDM4E
SCHEMBL30023648 0.76 INPPL1 (0.54) INPPL1INPP5AAKT1ALDH1A1KDM4E
SCHEMBL11783654 0.74 TSHR (0.53) ALDH1A1KDM4ELMNAMAPTMEN1
SCHEMBL11251002 0.74 ALDH1A1 (0.46) ALDH1A1KDM4EHSD17B10HPGDLMNA
SCHEMBL9305301 0.73 KDM4E (0.70) INPPL1INPP5AAKT1ALDH1A1KDM4E
SCHEMBL10834699 0.71 CYP2C9 (0.65) ALDH1A1KDM4EHSD17B10HPGDLMNA
SCHEMBL156483 0.71 CTNNB1 (0.45) ALDH1A1KDM4EHSD17B10HPGDLMNA
SCHEMBL28383647 0.71 PKM (0.48) ALDH1A1LMNAMAPTMEN1ABCC3

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
EP-0363688-A1 Novel phosphoric acid derivatives and a method for determination of acid phosphatase activity using the same NITTO BOSEKI CO., LTD. (JP) 1990-04-18 EP claimed