SCHEMBL9723178

SCHEMBL9723178

CCOC(=O)C1(C(=O)O)OC1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 1/20 0.34
GAA P10253 3/20 0.34
POLB P06746 2/20 0.34
ATM Q13315 1/20 0.34
ALOX15 P16050 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SOAT1 P35610 1/20 0.33
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL9723156 0.90 ALDH1A1 (0.40) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL11435161 0.82 ALOX15 (0.41) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL7061157 0.75 ALDH1A1 (0.39) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL38663307 0.74 SMN1; SMN2 (0.32) GAAATMSMN1; SMN2PPM1BPTPN1
SCHEMBL4401205 0.71 ALDH1A1 (0.39) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL12181098 0.71 ALDH1A1 (0.39) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL8473845 0.71 LMNA (0.35) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL31536690 0.71 POLB (0.39) LMNAKDM4EALDH1A1HSD17B10GAA
SCHEMBL57715 0.68 OPRM1 (0.49) GAASMN1; SMN2MEN1KMT2A
SCHEMBL18482793 0.68 PPM1B (0.37) LMNAKDM4EALDH1A1HSD17B10GAA

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-5123951-A Ethylene response inducing agent and malonic acid derivative RHONE-POULENC NEDERLAND B.V. (NL) 1992-06-23 US disclosed