SCHEMBL6239055

SCHEMBL6239055

CC(C)CCCCCCCCCCN(CCN(CCO)CCO)CCN(CCO)CCO

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
KDM4C Q9H3R0 2/20 0.37
KDM4A O75164 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
ALDH1A1 P00352 1/20 0.34
PLA2G1B P04054 1/20 0.31
PLA2G2A P14555 1/20 0.31
SLC29A1 Q99808 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
SCHEMBL9319584 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL5652783 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL15563205 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL31365935 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL7759645 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL2047008 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL31365936 0.98 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL24592051 0.90 PLA2G1B (0.44) LMNAKDM4CPHF8ALDH1A1PLA2G1B
SCHEMBL2036981 0.89 LMNA (0.39) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL9945683 0.89 ALDH1A1 (0.38) LMNAKDM4CKDM4APHF8KDM2A

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
WO-2005014528-A1 STRAIGHT-CHAIN AND BRANCHED-CHAIN LIPID COMPOUNDS AS SELECTIVE INHIBITORS OF CYCLOOXYGENASE-2, ANTI-INFLAMMATORY AGENTS, AND ANTI-CANCER AGENTS YANG ZHENHUA (US) 2005-02-17 WO disclosed