SCHEMBL14535101

SCHEMBL14535101

CC(C)(C)OC(=O)CCOC(=O)C1CC2C=C[C@@H]1C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 3/20 0.41
KMT2A Q03164 3/20 0.41
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 2/20 0.39
APEX1 P27695 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
ESR2 Q92731 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 2/20 0.36
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL13042862 1.00 ALDH1A1 (0.41) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL3362935 0.86 ALDH1A1 (0.50) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL14221808 0.82 ALDH1A1 (0.30) ALDH1A1HPGD
SCHEMBL14534917 0.81 KDM4E (0.49) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL14628488 0.81 KDM4E (0.49) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL525537 0.81 KDM4E (0.49) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL30862606 0.81 KDM4E (0.49) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL13897067 0.81 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL10388301 0.81 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A
SCHEMBL14213298 0.81 ALDH1A1 (0.53) ALDH1A1HPGDPOLBKMT2ARAB9A

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
WO-2007057773-A2 PHOTOACTIVE COMPOUNDS AZ ELECTRONIC MATERIALS USA CORP. (DE) 2007-05-24 WO disclosed
WO-2007007175-A2 PHOTOACTIVE COMPOUNDS AZ ELECTRONIC MATERIAL USA CORP. (DE) 2007-01-18 WO disclosed