SCHEMBL11464310

SCHEMBL11464310

CC(C)CCCCNC(C)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
KDM4C Q9H3R0 2/20 0.32
KDM4A O75164 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TRPA1 O75762 1/20 0.32
KISS1R Q969F8 1/20 0.31
BLM P54132 1/20 0.31
MEN1 O00255 1/20 0.30
XBP1 P17861 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ABCB11 O95342 1/20 0.30
ALDH1A1 P00352 1/20 0.30
EGFR P00533 1/20 0.30
ESR1 P03372 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
FYN P06241 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
SCHEMBL11452987 0.98 LMNA (0.40) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL11474573 0.98 LMNA (0.40) LMNAKDM4CKDM4APHF8KDM2A
SCHEMBL11453015 0.92 LMNA (0.38) LMNAKISS1RBLM
SCHEMBL4202303 0.87 ALDH1A1 (0.34) LMNAMEN1XBP1KMT2ANPSR1
SCHEMBL4209411 0.84 SIGMAR1 (0.37) LMNATRPV1TRPA1MEN1XBP1
SCHEMBL4202305 0.84 SIGMAR1 (0.37) LMNATRPV1TRPA1MEN1XBP1
SCHEMBL6695787 0.81
SCHEMBL4211600 0.81 TSHR (0.32) LMNAMEN1XBP1KMT2ANPSR1
SCHEMBL16306468 0.79 TRPV1 (0.43) LMNATRPV1TRPA1BLMMEN1
SCHEMBL12039773 0.79 LMNA (0.46) 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
US-4223138-A VAPORIZATION, CONDENSATION, RETARDING FLOW TO REACTION ZONE BAYER AKTIENGESELLSCHAFT (DE) 1980-09-16 US disclosed