SCHEMBL11228571

SCHEMBL11228571

CCCN(CCCCCCO)C(N)CC(N)NCCCCCCO

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL11237792 0.91
SCHEMBL11236610 0.80 TDP1 (0.31)
SCHEMBL11233365 0.77
SCHEMBL10755027 0.71 LMNA (0.44) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL2637709 0.70 SMN1; SMN2 (0.39) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL10705706 0.69 LMNA (0.48) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL10752575 0.69 LMNA (0.48) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL28208724 0.66 FDPS (0.35)
SCHEMBL10145249 0.66 SMN1; SMN2 (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL11228573 0.66 TDP1 (0.35) LMNAHSD17B10MEN1KMT2ATSHR

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-4326054-A ANTIBIOTIC AND ANTITUMOR AGENT ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1982-04-20 US disclosed