SCHEMBL9544578

SCHEMBL9544578

CC(C)N(C(=O)c1ccc(Cc2ccc3c(c2)OCCCO3)cc1)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.47
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
TSHR P16473 4/20 0.44
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 2/20 0.40
SLC6A9 P48067 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 2/20 0.39
CASP3 P42574 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL10453097 0.78 SLC6A9 (0.51) TRPM8NPC1RAB9AMEN1KMT2A
SCHEMBL9544541 0.77 TRPM8 (0.46) TRPM8NPC1RAB9ATSHRMEN1
SCHEMBL9208637 0.76 SLC6A9 (0.44) MEN1KMT2AGAASLC6A9ALDH1A1
SCHEMBL9542254 0.76 TRPM8 (0.55) TRPM8NPC1RAB9ATSHRMEN1
SCHEMBL9544546 0.76 TRPM8 (0.55) TRPM8NPC1RAB9ATSHRMEN1
SCHEMBL9540822 0.75 THRB (0.46) MEN1KMT2AGAASLC6A9ALDH1A1
SCHEMBL9540784 0.72 MEN1 (0.47) TRPM8RAB9AMEN1KMT2AGAA
SCHEMBL12917871 0.72 ALDH1A1 (0.58) NPC1RAB9ATSHRMEN1KMT2A
SCHEMBL10453321 0.71 MAPT (0.50) TRPM8TSHRMEN1KMT2ASLC6A9
SCHEMBL9542226 0.71 TRPM8 (0.47) TRPM8MEN1KMT2AGAASLC6A9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5223539-A Antagonist of platelet activating factor G. D. SEARLE & CO. (US) 1993-06-29 US disclosed
WO-1993010077-A1 N,N-DI-ALKYL(PHENOXY)BENZAMIDE DERIVATIVES G.D. SEARLE & CO. (US) 1993-05-27 WO disclosed