SCHEMBL9617096

SCHEMBL9617096

CC1(C)CCc2cc3c(cc2O1)CCC(=O)N3

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 1/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ MAPK13 O15264 1/20 0.38
▸ MAPK12 P53778 1/20 0.38
▸ MAPK11 Q15759 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ RAB9A P51151 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ TRPV1 Q8NER1 5/20 0.37
▸ MGAM O43451 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SI P14410 1/20 0.36
▸ MGAM2 Q2M2H8 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KIF11 P52732 3/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35

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
SCHEMBL5308527 0.74 NPC1 (0.43) KMT2ANPC1RAB9AMAPTMGAM
SCHEMBL29433775 0.70 CA9 (0.47) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL9092910 0.70 CA9 (0.47) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL10754154 0.70 MAPT (0.39) KMT2ANPC1RAB9AMAPTPKM
SCHEMBL9626749 0.70 PDE4D (0.38) KMT2ANPC1MAPK13MAPK12MAPK11
SCHEMBL6916096 0.69 CA9 (0.50) CA9NPC1MAPK13MAPK12MAPK11
SCHEMBL31260274 0.68 KDM4E (0.51) KMT2AMAPTGAA
SCHEMBL852444 0.68 CA9 (0.52) CA9KMT2ANPC1MAPK13MAPK12
SCHEMBL577986 0.66 BCHE (0.49) NPC1RAB9AMAPT
SCHEMBL28157945 0.66 PDE10A (0.40) KMT2ANPC1RAB9AMAPTMGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4013681-A — — None — — JP disclosed
JP-H0413681-A NOVEL PYRANOQUINOLINONE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVE AS ACTIVE COMPONENT KODAMA KK 1992-01-17 — — JP disclosed
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