SCHEMBL20345840

SCHEMBL20345840

C=C(/C=C\C=C/C)Oc1ccc2c(c1)C(=O)OC2=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
ALDH1A1 P00352 1/20 0.32
PTGES O14684 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 1/20 0.31
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 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
SCHEMBL11908094 0.79 PIK3C3 (0.41) CA2PIK3C3ALDH1A1NPC1RAB9A
SCHEMBL20345784 0.77 CA2 (0.33) CA2PIK3C3ALDH1A1NPC1RAB9A
SCHEMBL20346199 0.76 KMT2A (0.45) ALDH1A1NPC1MEN1KMT2APOLB
SCHEMBL20346205 0.76 CA2 (0.33) CA2PIK3C3ALDH1A1NPC1RAB9A
SCHEMBL14096713 0.73 ELANE (0.33) ALDH1A1ALOX15TDP1MEN1KMT2A
SCHEMBL17717380 0.73 ELANE (0.49) CA2ALDH1A1NPC1ALOX15TDP1
SCHEMBL17481246 0.72 TYMS (0.46) CA2PIK3C3ALDH1A1NPC1RAB9A
SCHEMBL4474802 0.71 CA12 (0.51) ALDH1A1NPC1RAB9ATDP1MEN1
SCHEMBL12337780 0.71 ALOX15 (0.43) CA2ALDH1A1PTGESALOX15TDP1
SCHEMBL28643301 0.69 ELANE (0.38) CA2ALDH1A1NPC1MEN1KMT2A

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
WO-2018122705-A1 METHODS FOR THE MANUFACTURE OF POLYETHERIMIDES AND POLYETHERIMIDES MADE BY THE METHOD SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-07-05 WO disclosed