SCHEMBL11658709

SCHEMBL11658709

O=C(Oc1cncc(OC(=O)C2CC2)c1)C1CC1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ELANE P08246 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.40
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL747331 0.88 HTT (0.44) KMT2AHTTSMN1; SMN2TDP1POLB
SCHEMBL27901226 0.86 HTT (0.43) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL27830136 0.81 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL25348366 0.81 HTT (0.54) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL27999904 0.78 ALDH1A1 (0.51) KMT2AHTTSMN1; SMN2TDP1ELANE
Hydrochloric Acid SCHEMBL28617927 0.77 KMT2A (0.51) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL11823665 0.76 KMT2A (0.83) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL20558316 0.76 KMT2A (0.62) KMT2AHTTSMN1; SMN2TDP1ELANE
Hydrochloric Acid SCHEMBL28617837 0.74 KMT2A (0.60) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL8654255 0.73 POLB (0.57) KMT2AHTTSMN1; SMN2TDP1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4093622-A Pyridine esters of cyclopropane-carboxylic acid ZOECON CORPORATION (US) 1978-06-06 US disclosed