SCHEMBL3264046

SCHEMBL3264046

C=CCOc1[nH]c2ccccc2c1C(=O)OC(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
HSD17B10 Q99714 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.46
ALOX5 P09917 2/20 0.46
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
APOBEC3A P31941 1/20 0.44
CASP6 P55212 1/20 0.44
KMT2A Q03164 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 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
SCHEMBL3263245 0.86 ALOX5 (0.60) KDM4EHSD17B10ALDH1A1HPGDMAPK1
SCHEMBL3264074 0.83 KMT2A (0.53) KDM4EHSD17B10ALDH1A1MAPK1ALOX5
SCHEMBL3265812 0.80 KMT2A (0.43) KDM4EHSD17B10ALDH1A1MAPK1ALOX5
SCHEMBL28243565 0.73 KDM4E (0.56) KDM4EHSD17B10ALDH1A1HPGDALOX5
SCHEMBL31486047 0.69 KDM4E (0.53) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL3261338 0.68 NR4A2 (0.56) KDM4EHSD17B10ALDH1A1HPGDALOX5
SCHEMBL8181582 0.68 MAPT (0.54) KDM4EHSD17B10ALDH1A1HPGDMEN1
SCHEMBL8173489 0.68 ALDH1A1 (0.49) KDM4EHSD17B10ALDH1A1HPGDALOX5
SCHEMBL7428961 0.67 NR4A2 (0.57) KDM4EHSD17B10ALDH1A1HPGDALOX5
SCHEMBL3151973 0.67 NR4A2 (0.59) KDM4EHSD17B10ALDH1A1HPGDALOX5

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-2010008727-A1 ASYMMETRIC SYNTHESIS OF ALLYL OR ALLENE OXINDOLES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-01-21 WO disclosed