SCHEMBL9049778

SCHEMBL9049778

COc1ccc(/C=C2\CC(=O)OC2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.59
DYRK1B Q9Y463 3/20 0.59
MAPT P10636 2/20 0.59
CLK1 P49759 2/20 0.56
CYP1A2 P05177 1/20 0.55
MAOB P27338 2/20 0.51
EGFR P00533 1/20 0.49
ACHE P22303 1/20 0.48
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
CES2 O00748 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPK1 P28482 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
PIM1 P11309 1/20 0.46
AKR1B1 P15121 1/20 0.46
PIM2 Q9P1W9 1/20 0.46
TUBB4A P04350 1/20 0.46

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
SCHEMBL9049784 1.00 DYRK1A (0.59) DYRK1ADYRK1BMAPTCLK1CYP1A2
SCHEMBL9049105 0.81 KMT2A (0.51) DYRK1ADYRK1BMAPTCYP1A2MAOB
SCHEMBL9049098 0.81 KMT2A (0.51) DYRK1ADYRK1BMAPTCYP1A2MAOB
SCHEMBL4401889 0.81 MAPT (0.53) MAPTMAOBACHEKMT2AALDH1A1
SCHEMBL10335357 0.80 MAPT (0.61) MAPTCYP1A2KMT2AALDH1A1LMNA
SCHEMBL7399707 0.79 CYP1A2 (0.53) MAPTCYP1A2MAOBALDH1A1KDM4E
SCHEMBL6660533 0.79 CYP1A2 (0.53) MAPTCYP1A2MAOBALDH1A1KDM4E
SCHEMBL9047840 0.79 CYP1A2 (0.53) MAPTCYP1A2MAOBALDH1A1KDM4E
SCHEMBL4400352 0.79 MAOB (0.41) MAPTMAOBACHEKDM4ENPC1
SCHEMBL9047782 0.78 AKR1C3 (0.50) CYP1A2MAOBEGFRACHEPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed