SCHEMBL11255472

SCHEMBL11255472

C=C(C)CCCCCCC1CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 4/20 0.41
PHF8 Q9UPP1 4/20 0.41
KDM2A Q9Y2K7 4/20 0.41
KDM4C Q9H3R0 3/20 0.41
KDM7A Q6ZMT4 1/20 0.41
SIGMAR1 Q99720 3/20 0.36
KDM4A O75164 1/20 0.34
CYP1A2 P05177 1/20 0.33
HTT P42858 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
NAAA Q02083 2/20 0.32
TP53 P04637 1/20 0.31
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL11274166 0.91 SIGMAR1 (0.47) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL27694515 0.91
SCHEMBL11274111 0.90 SIGMAR1 (0.50) KDM5APHF8KDM2AKDM4CSIGMAR1
SCHEMBL11262734 0.87 CYP1A2 (0.50) KDM5APHF8KDM2AKDM4CSIGMAR1
SCHEMBL20343055 0.81 LMNA (0.36) SIGMAR1CYP1A2HTTMAPTLMNA
SCHEMBL23158250 0.81 CYP1A2 (0.35) KDM5APHF8KDM2AKDM4CSIGMAR1
SCHEMBL6338008 0.80 CYP1A2 (0.52) KDM5APHF8KDM2AKDM4CSIGMAR1
SCHEMBL12513177 0.77 KDM5A (0.49) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL8023937 0.77 KDM5A (0.49) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL9978410 0.77 KDM5A (0.49) KDM5APHF8KDM2AKDM4CKDM7A

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