SCHEMBL9511069

SCHEMBL9511069

CC(O)CCC(C)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL15943072 1.00 MAPK1 (0.42) MAPK1TDP1TSHR
SCHEMBL13536717 0.79 LMNA (0.33)
SCHEMBL223936 0.77 MAPK1 (0.33) MAPK1
SCHEMBL17266276 0.77 MAPK1 (0.44) MAPK1TDP1TSHR
SCHEMBL9508682 0.75 GABRR1 (0.46)
SCHEMBL13391048 0.74 TSHR (0.32) TSHR
SCHEMBL13536739 0.73 MAPK1 (0.31) MAPK1
SCHEMBL13536727 0.73 MAPK1 (0.31) MAPK1
SCHEMBL11438635 0.73 MAPK1 (0.38) MAPK1TDP1TSHR
SCHEMBL713742 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0388960-B1 OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE HITACHI, LTD. (JP) 1993-10-06 EP disclosed
US-5152919-A Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range HITACHI, LTD. (JP) 1992-10-06 US disclosed
EP-0388960-A1 Optically active compounds and their preparation and use HITACHI, LTD. (JP) 1990-09-26 EP disclosed