SCHEMBL9687353

SCHEMBL9687353

CCOC(=O)c1cnc2c(c1O)CCCCCC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.48
KDM4E B2RXH2 7/20 0.47
ALDH1A1 P00352 3/20 0.44
GLA P06280 3/20 0.44
GAA P10253 3/20 0.44
LMNA P02545 3/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.44
HTT P42858 2/20 0.44
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
RECQL P46063 1/20 0.40

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
SCHEMBL9693221 1.00 ACHE (0.48) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9686653 1.00 ACHE (0.48) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9686907 1.00 ACHE (0.48) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL2288150 0.99 KDM4E (0.48) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9693584 0.96 ACHE (0.47) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL7912951 0.87 ACHE (0.49) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9687387 0.85 ACHE (0.50) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9693236 0.85 ACHE (0.50) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9686312 0.85 ACHE (0.50) ACHEKDM4EALDH1A1GLAGAA
SCHEMBL9685361 0.85 ACHE (0.50) ACHEKDM4EALDH1A1GLAGAA

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-0270494-B1 Certain cycloalka- [b]-pyrazolo-[3,4-d]-pyridin-3-one derivatives CIBA-GEIGY AG (CH) 1992-08-19 EP disclosed
US-4826854-A Certain cycloalka-(b)-pyrazolo(3,4-d)-pyridin-3-one derivatives CIBA-GEIGY CORPORATION (US) 1989-05-02 US disclosed
EP-0270494-A2 Certain cycloalka- [b]-pyrazolo-[3,4-d]-pyridin-3-one derivatives CIBA-GEIGY AG (CH) 1988-06-08 EP disclosed