SCHEMBL9426166

SCHEMBL9426166

CCCCN(C)C(=O)CCc1ccc2c(c1)OCCO2

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 4/20 0.47
RAB9A P51151 2/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
TRPV1 Q8NER1 1/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
CDK8 P49336 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42

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
SCHEMBL9425827 0.81 CDK8 (0.39) TRPM8KMT2ARAB9ACDK8CLK4
SCHEMBL9426010 0.81 CDK8 (0.39) TRPM8KMT2ARAB9ACDK8CLK4
SCHEMBL9425793 0.81 HPGD (0.58) TRPM8HPGDTRPV1
SCHEMBL9425976 0.79 TRPM8 (0.62) TRPM8MEN1KMT2AHPGDRAB9A
SCHEMBL8122254 0.79 SIGMAR1 (0.45) PTGDR2MEN1KMT2AHPGDRAB9A
SCHEMBL9346628 0.78 IAPP (0.62) MEN1KMT2AHPGDRAB9ATP53
SCHEMBL9426557 0.78 TRPM8 (0.57) TRPM8HPGDTRPV1
SCHEMBL9425817 0.77 TRPM8 (0.41) TRPM8MEN1KMT2ARAB9AALDH1A1
SCHEMBL8349898 0.76 TRPM8 (0.62) TRPM8KMT2AHPGDRAB9AALDH1A1
SCHEMBL18414428 0.76 TRPV1 (0.52) HPGDRAB9ATP53MAPTHTT

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-5338745-A Alzheimer's disease MITSUI TOATSU CHEMICALS, INCORPORATION (JP) 1994-08-16 US disclosed
EP-0495998-A1 DIHYDROCAFFEIC ACID AMIDE DERIVATIVE AND APPLICATION THEREOF AS MEDICINE MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-07-29 EP disclosed