SCHEMBL10960435

SCHEMBL10960435

CCOC(=O)C1=C(C(=O)OCC)C1OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
TSHR P16473 2/20 0.50
KDM4E B2RXH2 2/20 0.50
GAA P10253 3/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 5/20 0.46
HPGD P15428 2/20 0.46
TP53 P04637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HTT P42858 1/20 0.43
FHIT P49789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1417041 0.78 ALDH1A1 (0.44) LMNATSHRKDM4EGAAPOLB
SCHEMBL31296900 0.71 LMNA (0.50) LMNATSHRKDM4EGAAPOLB
SCHEMBL11008658 0.71 ALDH1A1 (0.62) LMNATSHRKDM4EGAAALDH1A1
SCHEMBL5429764 0.68 LMNA (0.47) LMNATSHRKDM4EGAAPOLB
SCHEMBL2328254 0.68 LMNA (0.47) LMNATSHRKDM4EGAAPOLB
SCHEMBL10444735 0.67 ALDH1A1 (0.58) TSHRKDM4EGAAPOLBALDH1A1
SCHEMBL9397467 0.67 ALDH1A1 (0.58) TSHRGAAPOLBALDH1A1HPGD
SCHEMBL31303968 0.67 KDM4E (0.46) LMNATSHRKDM4EGAAPOLB
SCHEMBL31376339 0.67 KDM4E (0.46) LMNATSHRKDM4EGAAPOLB
SCHEMBL3503405 0.67 KDM4E (1.00) LMNATSHRKDM4EGAAPOLB

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-4552883-A CNS DEPRESSANTS, ANXIOLYTICS ICI AMERICAS INC. (US) 1985-11-12 US disclosed