SCHEMBL9513613

SCHEMBL9513613

O=C1OCOC(=O)[C@H]2CC[C@H]1CC2

nearest known ligand 0.31

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
PPM1B O75688 1/20 0.31
LMNA P02545 1/20 0.31
PPP1CC P36873 1/20 0.31
TFPI2 P48307 1/20 0.31
RAB9A P51151 1/20 0.31
PPP5C P53041 1/20 0.31
PPP1CA P62136 1/20 0.31
PMP22 Q01453 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TP53 P04637 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 1/20 0.31

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
SCHEMBL1082460 0.81 LMNA (0.35) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL7076734 0.77 CA1 (0.42) LMNATP53
SCHEMBL16705145 0.77 CA1 (0.42) LMNATP53
SCHEMBL10877625 0.77 CA1 (0.42) LMNATP53
SCHEMBL600356 0.75 CYP2D6 (0.31) CYP2D6
SCHEMBL10815095 0.75 CA1 (0.40) LMNATP53
SCHEMBL22064182 0.75 CYP2D6 (0.31) CYP2D6
SCHEMBL7760519 0.73 KDM4E (0.46) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL2828981 0.73 KDM4E (0.46) KDM4EGMNNPPM1BLMNAPPP1CC
SCHEMBL10997323 0.71

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-0572520-A1 POWDER COATING COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 1993-12-08 EP disclosed
WO-1992014770-A1 POWDER COATING COMPOSITIONS EASTMAN KODAK COMPANY (US) 1992-09-03 WO disclosed