SCHEMBL7437293

SCHEMBL7437293

CCOc1cc(C(=O)Cl)ccn1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 1/20 0.48
MAPT P10636 1/20 0.44
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ACACB O00763 4/20 0.41
CTSA P10619 1/20 0.38
JMJD6 Q6NYC1 2/20 0.38
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP1B1 Q16678 1/20 0.37
MAPK8 P45983 1/20 0.36

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
SCHEMBL14480077 0.84 CREBBP (0.50) PROKR1MAPTKMT2ANPSR1ACACB
SCHEMBL1992514 0.84 MAPT (0.57) PROKR1MAPTKMT2ANPSR1JMJD6
SCHEMBL30723841 0.84 MAPT (0.57) PROKR1MAPTKMT2ANPSR1JMJD6
SCHEMBL6241029 0.83 PARP10 (0.51) PROKR1MAPTKMT2ANPSR1ACACB
SCHEMBL17478456 0.83 MAPT (0.56) PROKR1MAPTKMT2ANPSR1JMJD6
SCHEMBL30281260 0.83 PARP10 (0.51) PROKR1MAPTKMT2ANPSR1ACACB
SCHEMBL31637653 0.82 KCNK3 (0.50) PROKR1CTSA
SCHEMBL2431121 0.82 KCNK3 (0.50) PROKR1CTSA
SCHEMBL29173821 0.81 KDM4E (0.55) PROKR1MAPTACACBJMJD6NPC1
SCHEMBL3723629 0.81 JMJD6 (0.56) JMJD6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0059948-B1 NOVEL AROYLIMIDAZOLONES MERRELL DOW PHARMACEUTICALS INC. (US) 1985-11-13 EP disclosed
US-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 US disclosed
EP-0059948-A1 Novel aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-09-15 EP disclosed