SCHEMBL472150

SCHEMBL472150

O=C(OCC1CC=CCC1)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ALDH1A1 P00352 7/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ PKM P14618 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ CCNB1 P14635 1/20 0.34
▸ CCNA2 P20248 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ CCNA1 P78396 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ ADRB2 P07550 1/20 0.33

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
SCHEMBL11338767 0.98 KDM4E (0.40) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL17616840 0.92 MAPK1 (0.39) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL472104 0.87 MIF (0.40) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL17616827 0.85 CYP3A4 (0.49) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL12431720 0.84 LMNA (0.42) KDM4ETDP1ALDH1A1LMNAMEN1
SCHEMBL12510737 0.84 MAPK1 (0.33) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL17616828 0.81 MAPK1 (0.39) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL17616839 0.79 MAPK1 (0.42) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL17601883 0.79 MAPK1 (0.42) KDM4ETDP1ALDH1A1MAPK1PKM
SCHEMBL15911845 0.79 LMNA (0.48) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2

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
EP-2412712-A1 METHOD FOR PRODUCING EPOXY COMPOUND Showa Denko K.K. (JP) 2012-02-01 — — EP disclosed
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