SCHEMBL11274166

SCHEMBL11274166

C=C(C)CCCCCCC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.47
CYP1A2 P05177 1/20 0.45
KDM5A P29375 4/20 0.44
PHF8 Q9UPP1 4/20 0.44
KDM2A Q9Y2K7 4/20 0.44
KDM4C Q9H3R0 3/20 0.44
KDM4A O75164 1/20 0.42
NAAA Q02083 2/20 0.40
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GLA P06280 2/20 0.37
KDM7A Q6ZMT4 1/20 0.35
EPHX1 P07099 2/20 0.34

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
SCHEMBL11274111 0.98 SIGMAR1 (0.50) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL11262734 0.96 CYP1A2 (0.50) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL11255472 0.91 KDM5A (0.41) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL6338008 0.89 CYP1A2 (0.52) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL23158250 0.85 CYP1A2 (0.35) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL27694515 0.82
SCHEMBL27390168 0.82 SIGMAR1 (0.47) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL8124638 0.81 SIGMAR1 (0.54) SIGMAR1CYP1A2KDM5APHF8KDM2A
SCHEMBL20902891 0.80 CYP1A2 (0.44) SIGMAR1CYP1A2MEN1CYP3A4KMT2A
SCHEMBL8025386 0.79 KDM5A (0.51) SIGMAR1CYP1A2KDM5APHF8KDM2A

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-0046961-A1 Epoxy-cycloalkylalkanecarboxylic acids, process for their preparation, their use and medicaments containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-03-10 EP disclosed