SCHEMBL9734889

SCHEMBL9734889

O=C(O)C1CCN(C2CCCCC2)C(=O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
GAA P10253 1/20 0.46
HSD11B1 P28845 2/20 0.41
PARP1 P09874 1/20 0.38
HTT P42858 1/20 0.38
ESR2 Q92731 1/20 0.38
PARP2 Q9UGN5 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GRM5 P41594 1/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL893008 0.82 POLB (0.49) POLBGAAHSD11B1NPSR1LMNA
SCHEMBL14230530 0.82 POLB (0.49) POLBGAAHSD11B1NPSR1LMNA
SCHEMBL17704768 0.72 POLB (0.42) POLBGAAHSD11B1PARP1HTT
SCHEMBL892454 0.72 MEN1 (0.47) POLBGAAHSD11B1KMT2AMEN1
SCHEMBL1069501 0.68 HSD11B1 (0.40) POLBGAAHSD11B1PARP1HTT
SCHEMBL4515274 0.67 NPC1 (0.42) POLBGAAHSD11B1NPSR1ALDH1A1
SCHEMBL9734800 0.66 MAPT (0.56) POLBGAAALDH1A1SMN1; SMN2KMT2A
SCHEMBL9243589 0.66 GRM5 (0.40) POLBGAAHSD11B1GRM5
SCHEMBL5381512 0.65 PARP2 (0.46) PARP1PARP2
SCHEMBL8659553 0.64 NOS3 (0.41) POLBGAAHSD11B1PARP1HTT

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
US-5132424-A Anticholesterol, treatment of atherosclerosis THE UPJOHN COMPANY (US) 1992-07-21 US disclosed
EP-0425541-A1 PYRAZOLO-AZOLO-PYRIMIDINE-DIONES THE UPJOHN COMPANY (US) 1991-05-08 EP disclosed
WO-1990001031-A1 PYRAZOLO-PYRROLO-PYRIMIDINE-DIONES THE UPJOHN COMPANY (US) 1990-02-08 WO disclosed