SCHEMBL9521880

SCHEMBL9521880

CCOC(=O)Oc1cccnc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.58
CDK8 P49336 1/20 0.58
KMT2A Q03164 6/20 0.52
LMNA P02545 1/20 0.49
ALOX15 P16050 2/20 0.48
FAAH O00519 1/20 0.47
MAPT P10636 6/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
NPC1 O15118 1/20 0.47
PKM P14618 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
USP2 O75604 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
POLB P06746 1/20 0.45

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
Hydrochloric Acid SCHEMBL9839090 0.98 CCNC (0.57) CCNCCDK8KMT2ALMNAALOX15
SCHEMBL6209531 0.84 KMT2A (0.65) CCNCCDK8KMT2ALMNAFAAH
SCHEMBL12150066 0.84 CCNC (0.53) CCNCCDK8KMT2ALMNAALOX15
SCHEMBL6294601 0.84 KMT2A (0.57) CCNCCDK8KMT2ALMNAALOX15
SCHEMBL11200179 0.82 KMT2A (0.48) CCNCCDK8KMT2AALOX15FAAH
SCHEMBL28000128 0.81 CCNC (0.50) CCNCCDK8KMT2ALMNAALOX15
SCHEMBL9002813 0.81 KMT2A (0.59) CCNCCDK8KMT2AALOX15FAAH
SCHEMBL6213582 0.80 KMT2A (0.64) CCNCCDK8KMT2ALMNAALDH1A1
SCHEMBL29473371 0.79 CCNC (0.57) CCNCCDK8KMT2ALMNAALOX15
SCHEMBL4059898 0.79 CCNC (0.57) CCNCCDK8KMT2ALMNAALOX15

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0302253-B1 3-DEMETHYL-4-FLUORO-MEVALONIC-ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS BASED ON THOSE COMPOUNDS, THEIR USE AND INTERMEDIATES HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-07 EP disclosed
EP-0281789-B1 BENZYLAMINOARYLDIHYDROPYRIDINE LACTONES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN MEDICAMENTS BAYER AG (DE) 1991-04-17 EP disclosed
EP-0302253-A1 3-Demethyl-4-fluoro-mevalonic-acid derivatives, process for their preparation, pharmaceutical preparations based on those compounds, their use and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1989-02-08 EP disclosed
EP-0157324-B1 TETRAHYDROTHIENOPYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL APPLICATION BAYER AG (DE) 1988-08-31 EP disclosed
EP-0234517-A1 Pyrrolo[3,4-b]pyridines, process for their preparation and medicaments containing them for the treatment of vascular diseases GÖDECKE AKTIENGESELLSCHAFT (DE) 1987-09-02 EP disclosed
EP-0202436-A2 Process for dyeing or printing cellulosic fibres or cellulosic mixed fibres HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-26 EP disclosed
EP-0123095-A2 Chromone- and thiochromone-substited 1,4-dihydropyridine lactones, processes for their preparation and their use as pharmaceutical preparations BAYER AG (DE) 1984-10-31 EP disclosed