SCHEMBL11212145

SCHEMBL11212145

CCCCCCCCCCCCCCCCCC(CCCCCCC)NCCCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.48
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.44
EPHX1 P07099 1/20 0.39
CYP2D6 P10635 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SPHK1 Q9NYA1 1/20 0.38
GMNN O75496 1/20 0.38
POLB P06746 1/20 0.38
THPO P40225 1/20 0.38
MTOR P42345 1/20 0.38
BLM P54132 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL23219748 1.00 LMNA (0.48) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL117119 0.92 LMNA (0.44) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1618085 0.92 LMNA (0.44) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9949550 0.91 ALDH1A1 (0.43) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1619918 0.90 LMNA (0.45) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL26999627 0.89 LMNA (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL31284732 0.89 LMNA (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL30786802 0.89 LMNA (0.46) LMNAALDH1A1HSD17B10MEN1KMT2A
Hydrochloric Acid SCHEMBL9803172 0.88 LMNA (0.45) LMNAALDH1A1HSD17B10MEN1KMT2A
Hydrochloric Acid SCHEMBL7879376 0.88 LMNA (0.45) LMNAALDH1A1HSD17B10MEN1KMT2A

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-0013072-B1 LONG CHAIN AMINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-04-13 EP disclosed