SCHEMBL2524591

SCHEMBL2524591

COc1cc(C(=Cc2ccccc2)C(=O)O)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.58
AKR1C3 P42330 2/20 0.57
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
POLB P06746 2/20 0.56
SLC22A6 Q4U2R8 1/20 0.55
SLC22A8 Q8TCC7 1/20 0.55
RAB9A P51151 1/20 0.55
ALDH1A1 P00352 1/20 0.55
AKR1C2 P52895 1/20 0.54
AKR1C1 Q04828 1/20 0.54
KDM4E B2RXH2 2/20 0.53
APP P05067 1/20 0.51
MAPT P10636 1/20 0.51
GCGR P47871 1/20 0.50
KDM1A O60341 1/20 0.49
GAA P10253 1/20 0.48

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
SCHEMBL7814136 0.88 AKR1C3 (0.71) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL7814134 0.88 AKR1C3 (0.71) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL2951324 0.86 MEN1 (0.62) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL2951322 0.86 MEN1 (0.62) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL2523113 0.86 MEN1 (0.62) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL13744294 0.82 AKR1C2 (0.76) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL28696305 0.81 HTT (0.63) HTTMEN1KMT2APOLBSLC22A6
SCHEMBL28346803 0.81 HTT (0.63) HTTMEN1KMT2APOLBSLC22A6
SCHEMBL14125351 0.81 CXCL12 (0.62) HTTAKR1C3MEN1KMT2APOLB
SCHEMBL10665004 0.81 AKR1C3 (0.69) HTTAKR1C3MEN1KMT2APOLB

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
US-8039513-B2 Cis-1,2-substituted stilbene derivatives and their use in preparation of drugs for treatment and/or prevention of diabetes INSTITUTE OF RADIATION MEDICINE, ACADEMY OF MILITARY MEDICAL SCIENCES, PLA (CN) 2011-10-18 US disclosed