SCHEMBL9539028

SCHEMBL9539028

CCC(=O)N1CCC(=O)c2c1ccc(OCC(=O)OC)c2Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NOTUM Q6P988 1/20 0.37
PTGDR Q13258 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
THRB P10828 2/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
TRIM24 O15164 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
SCHEMBL9537955 0.79 NOTUM (0.47) KDM4EALDH1A1MAPTNOTUMTP53
SCHEMBL9540633 0.78 POLB (0.39) KDM4EALDH1A1MAPTNOTUMTP53
SCHEMBL9538910 0.77 ALDH1A1 (0.35) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL9540504 0.76 TP53 (0.44) KDM4ELMNAALDH1A1MAPTMEN1
SCHEMBL9539008 0.75 ALDH1A1 (0.35) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL9535907 0.66 NOTUM (0.47) MAPTNOTUMTHRBTP53POLB
SCHEMBL8816518 0.65 LMNA (0.58) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL9537960 0.65 TP53 (0.51) LMNAALDH1A1MAPTKMT2ANPC1
SCHEMBL9537808 0.63 TP53 (0.40) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL9536870 0.63 F10 (0.41) ALDH1A1MAPTMEN1KMT2ANOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 US disclosed
EP-0180352-A2 Benzene-fused heterocyclic compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed