SCHEMBL17997993

SCHEMBL17997993

CCCCCC(CCO)NCCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
OPRM1 P35372 1/20 0.38
FAAH O00519 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.37
CNR1 P21554 1/20 0.37
ADRA1A P35348 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ABCC3 O15438 1/20 0.35
TP53 P04637 1/20 0.35
EPHX1 P07099 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34
GMNN O75496 1/20 0.34
POLB P06746 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL28675328 0.98 LMNA (0.43) LMNASMN1; SMN2OPRM1FAAHALDH1A1
SCHEMBL30786802 0.94 LMNA (0.46) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
SCHEMBL26999627 0.94 LMNA (0.46) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
SCHEMBL31284732 0.94 LMNA (0.46) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL9803172 0.92 LMNA (0.45) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
SCHEMBL29059516 0.92 LMNA (0.45) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
SCHEMBL29059633 0.92 LMNA (0.45) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL7879376 0.92 LMNA (0.45) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL999467 0.92 LMNA (0.45) LMNASMN1; SMN2FAAHALDH1A1HSD17B10
SCHEMBL9949238 0.89 LMNA (0.41) LMNASMN1; SMN2ALDH1A1HSD17B10MEN1

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-2498746-B1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES UNILEVER PLC NO 41424 (GB) 2016-08-24 EP disclosed