SCHEMBL18419643

SCHEMBL18419643

O=C(O)C(OC(=O)C(O)(O)c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.39
SRC P12931 1/20 0.39
LMNA P02545 2/20 0.38
MAPK1 P28482 1/20 0.38
KCNN4 O15554 1/20 0.38
PPARG P37231 4/20 0.38
PPARA Q07869 2/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL7683069 0.79 ALDH1A1 (0.46) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL11791096 0.79 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL4591292 0.79 ALDH1A1 (0.42) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL12134271 0.75 SRC (0.50) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL11421306 0.74 MAPT (0.38) KCNN4PPARGPPARA
SCHEMBL1286155 0.72 ALDH1A1 (0.70) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL11810850 0.72 KMT2A (0.53) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL16001587 0.72 KMT2A (0.53) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL722642 0.72 CYP2D6 (0.48) ALDH1A1CYP3A4CYP2D6SRCLMNA
SCHEMBL493954 0.72 ALDH1A1 (0.70) ALDH1A1CYP3A4CYP2D6SRCLMNA

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
EP-3128540-A1 THERMOSETTING RESIN COMPOSITION, SEMICONDUCTOR DEVICE AND ELECTRICAL/ELECTRONIC COMPONENT KYOCERA Corporation (JP) 2017-02-08 EP disclosed