SCHEMBL8319948

SCHEMBL8319948

Cc1ccc(OC(=O)C2CCC2)cc1

nearest known ligand 0.81

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.81
HTT P42858 1/20 0.81
SMN1; SMN2 Q16637 1/20 0.81
TDP1 Q9NUW8 1/20 0.81
L3MBTL1 Q9Y468 1/20 0.58
ELANE P08246 2/20 0.55
POLB P06746 2/20 0.55
LMNA P02545 1/20 0.52
HPGD P15428 3/20 0.51
ATM Q13315 1/20 0.51
MEN1 O00255 2/20 0.49
MAPT P10636 1/20 0.49
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
CHRNA7 P36544 1/20 0.45
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44

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
SCHEMBL10291941 0.96 KMT2A (0.75) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL7100273 0.95 KMT2A (0.72) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL24605352 0.92 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL27947111 0.92 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL2741099 0.92 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL12370833 0.92 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL26038796 0.90 KMT2A (0.66) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL21185911 0.87 HTT (0.61) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
Cyclohexane Carboxamide SCHEMBL21771917 0.87 KMT2A (0.62) KMT2AHTTSMN1; SMN2TDP1L3MBTL1
SCHEMBL13612593 0.86 HTT (0.59) KMT2AHTTSMN1; SMN2TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0923536-A1 ARYLCYCLOALKANE CARBOXYLIC ESTERS, THEIR USE, PHARMACEUTICAL COMPOSITIONS AND PREPARATION Pharmacia & Upjohn Aktiebolag (SE) 1999-06-23 EP disclosed
WO-1998004517-A1 ARYLCYCLOALKANE CARBOXYLIC ESTERS, THEIR USE, PHARMACEUTICAL COMPOSITIONS AND PREPARATION PHARMACIA & UPJOHN AB (SE) 1998-02-05 WO disclosed