SCHEMBL851860

SCHEMBL851860

CCc1c(C(=O)O)ccc(OC)c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 2/20 0.45
MYC P01106 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
CDC25B P30305 1/20 0.43
TSHR P16473 1/20 0.41
KDM4E B2RXH2 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL8897402 0.86 MAPT (0.49) MAPTTDP1ALDH1A1MYCPPARG
SCHEMBL19705421 0.86 MAPT (0.51) MAPTTDP1ALDH1A1MYCPPARG
SCHEMBL1960268 0.85 MAPT (0.42) MAPTTDP1ALDH1A1MYCCDC25B
SCHEMBL3782773 0.83 MAPT (0.62) MAPTTDP1ALDH1A1MYCPPARG
SCHEMBL13285652 0.81 MAPT (0.47) MAPTTDP1ALDH1A1MYCPPARG
SCHEMBL10901788 0.81 GABRP (0.43) TDP1ALDH1A1MYCPPARGTSHR
SCHEMBL3966914 0.81 MAPT (0.44) MAPTTDP1ALDH1A1MYCPPARG
SCHEMBL12310835 0.81 S1PR3 (0.46)
SCHEMBL732725 0.80 MAPT (0.61) MAPTTDP1ALDH1A1MYCCDC25B
SCHEMBL13607855 0.79 MAPT (0.57) MAPTTDP1ALDH1A1MYCPPARG

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349983-B1 DIFLUORPHENYL DIACYLHYDRAZIDE DERIVATES MERCK PATENT GMBH (DE) 2016-09-14 EP disclosed
EP-2349983-B1 DIFLUORPHENYL DIACYLHYDRAZIDE DERIVATES MERCK PATENT GMBH (DE) 2016-09-14 EP disclosed
EP-2313380-B1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES MERCK PATENT GMBH (DE) 2013-12-11 EP disclosed
US-8546613-B2 SGK1 inhibitors for the prophylaxis and/or therapy of viral diseases and/or carcinomas MERCK PATENT GMBH (DE) 2013-10-01 US disclosed
US-8546613-B2 SGK1 inhibitors for the prophylaxis and/or therapy of viral diseases and/or carcinomas MERCK PATENT GMBH (DE) 2013-10-01 US disclosed
US-8492440-B2 Difluorophenyldiacylhydrazide derivatives MERCK PATENT GMBH (DE) 2013-07-23 US disclosed
US-8492440-B2 Difluorophenyldiacylhydrazide derivatives MERCK PATENT GMBH (DE) 2013-07-23 US disclosed
US-8492440-B2 Difluorophenyldiacylhydrazide derivatives MERCK PATENT GMBH (DE) 2013-07-23 US disclosed
US-8377975-B2 Oxadiazole derivatives for the treatment of diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-02-19 US disclosed
US-8377975-B2 Oxadiazole derivatives for the treatment of diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-02-19 US disclosed
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2011-06-16 US disclosed
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2011-06-16 US disclosed
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2011-06-16 US disclosed
US-20110060050-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS MERCK PATENT GMBH (DE) 2011-03-10 US disclosed
US-20110060050-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS MERCK PATENT GMBH (DE) 2011-03-10 US disclosed
EP-2242738-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS Merck Patent GmbH (DE) 2010-10-27 EP disclosed
WO-2010060522-A2 DIFLUORPHENYL DIACYLHYDRAZIDE DERIVATES MERCK PATENT GMBH (DE) 2010-06-03 WO disclosed
WO-2010060522-A2 DIFLUORPHENYL DIACYLHYDRAZIDE DERIVATES MERCK PATENT GMBH (DE) 2010-06-03 WO disclosed
WO-2010020305-A1 OXADIAZOLE DERIVATIVES FOR TREATING DIABETES MERCK PATENT GMBH (DE) 2010-02-25 WO disclosed
WO-2009103484-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS MERCK PATENT GMBH (DE) 2009-08-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110139654-A1 OXADIAZOLE DERIVATIVES FOR THE TREATMENT OF DIABETES PFKL, RXFP3, OXA1L MAPT 4325/4885TDP1 1697/4885ALDH1A1 2507/4885
US-20110060050-A1 SGK1 INHIBITORS FOR THE PROPHYLAXIS AND/OR THERAPY OF VIRAL DISEASES AND/OR CARCINOMAS NCOA1, NR3C2, NCOA2 MAPT 2569/4885TDP1 3849/4885ALDH1A1 2817/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.