SCHEMBL2569600

SCHEMBL2569600

CC(=O)C(C(=O)O)C1(c2ccccc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.42
OPRL1 P41146 4/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
APAF1 O14727 1/20 0.41
TDP2 O95551 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
ALOX12 P18054 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AKR1C1 Q04828 1/20 0.40
HDAC4 P56524 3/20 0.40
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
ATM Q13315 1/20 0.36
MEN1 O00255 1/20 0.36
ADRB2 P07550 1/20 0.36

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
SCHEMBL15258744 0.83 OPRM1 (0.45) OPRM1OPRL1ALDH1A1MAPTL3MBTL1
SCHEMBL16015556 0.79 OPRM1 (0.43) OPRM1OPRL1ALDH1A1MAPTAKR1C1
SCHEMBL19647226 0.76 OPRM1 (0.41) OPRM1OPRL1ALDH1A1MAPTAKR1C1
SCHEMBL19647052 0.76 OPRM1 (0.41) OPRM1OPRL1ALDH1A1MAPTAKR1C1
SCHEMBL19647087 0.74 AKR1C1 (0.40) OPRM1OPRL1ALDH1A1AKR1C1HDAC4
SCHEMBL27742157 0.73 AKR1C1 (0.42) OPRM1OPRL1ALDH1A1AKR1C1HDAC4
SCHEMBL11047935 0.73 OPRM1 (0.45) OPRM1OPRL1AKR1C1HDAC4OPRK1
SCHEMBL6670890 0.73 HDAC4 (0.42) OPRM1OPRL1ALDH1A1POLBAKR1C1
SCHEMBL17215183 0.70 AKR1C1 (0.40) OPRM1OPRL1ALDH1A1AKR1C1HDAC4
SCHEMBL14899045 0.70 AKR1C1 (0.48) OPRM1OPRL1ALDH1A1AKR1C1HDAC4

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-2382205-B1 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI SA (FR) 2014-04-23 EP disclosed
EP-2382205-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI (FR) 2011-11-02 EP disclosed
WO-2010076524-A2 DERIVATIVES OF 2-PYRIDIN-2-YL-PYRAZOL-3(2H)-ONE, PREPARATION AND THERAPEUTIC USE THEREOF AS HIF ACTIVATORS SANOFI-AVENTIS (FR) 2010-07-08 WO disclosed