SCHEMBL9565826

SCHEMBL9565826

CCCCCCCC(=O)N1CCN(c2ccccc2C(F)(F)F)CC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
MAPT P10636 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 1/20 0.55
AKR1C3 P42330 1/20 0.54
ALDH1A1 P00352 1/20 0.54
RBP4 P02753 2/20 0.51
NPSR1 Q6W5P4 1/20 0.50
GFER P55789 1/20 0.50
TRPV1 Q8NER1 3/20 0.49
AR P10275 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
GSK3B P49841 5/20 0.47
GNAI3 P08754 1/20 0.47
GNAI1 P63096 1/20 0.47
TTR P02766 1/20 0.46

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
SCHEMBL9565872 0.92 CNR1 (0.60) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL9565869 0.92 CNR1 (0.60) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL9565841 0.82 LMNA (0.60) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL9565914 0.82 LMNA (0.60) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL7923613 0.80 MAPT (0.53) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL9565850 0.79 AKR1C3 (0.61) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL28523079 0.79 HTR1A (0.67) LMNAMEN1KMT2ATSHRALDH1A1
SCHEMBL28907245 0.79 HTR1A (0.67) LMNAMEN1KMT2ATSHRALDH1A1
SCHEMBL12141090 0.79 MAPT (0.52) LMNAMAPTMEN1KMT2ATSHR
SCHEMBL14895381 0.78 LMNA (0.53) LMNAMAPTMEN1KMT2ATSHR

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-0548798-A1 Antiviral agent SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-06-30 EP disclosed