SCHEMBL19935993

SCHEMBL19935993

CCOC(=O)C(=O)c1ccc2oc3ccc(C(=O)C(=O)OCC)cc3c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.45
TSHR P16473 1/20 0.44
ALDH1A1 P00352 4/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 2/20 0.44
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
GABRA4 P48169 1/20 0.44
GABRE P78334 1/20 0.44
GABRA6 Q16445 1/20 0.44
GABRG1 Q8N1C3 1/20 0.44

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
SCHEMBL19936080 0.93 GABRP (0.54) TNKSALDH1A1SMN1; SMN2GABRPGABRD
SCHEMBL28480151 0.92 CES2 (0.43) TNKSTSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL16595943 0.92 CA12 (0.46) TNKSTSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL19924558 0.79 ALDH1A1 (0.49) TSHRALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL19924552 0.79 ALDH1A1 (0.49) TSHRALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL2491600 0.77 CTNNB1 (0.56)
SCHEMBL21096574 0.77 GABRP (0.64) TNKSTSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL2124739 0.76 CES2 (0.55) ALDH1A1KMT2ASMN1; SMN2HTTKDM4E
SCHEMBL9863135 0.75 ALDH1A1 (0.56) TSHRALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL2124837 0.75 MAPK1 (0.58) TSHRALDH1A1KMT2ASMN1; SMN2MEN1

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-3507279-B1 POLYCYCLIC GLYOXYLATES AS PHOTOINITIATORS IGM GROUP B V (NL) 2020-10-14 EP disclosed
US-20190211184-A1 POLYCYCLIC GLYOXYLATES AS PHOTOINITIATORS IGM GROUP B.V. (NL) 2019-07-11 US disclosed
WO-2018041935-A1 POLYCYCLIC GLYOXYLATES AS PHOTOINITIATORS IGM GROUP B.V. (NL) 2018-03-08 WO disclosed