SCHEMBL6093310

SCHEMBL6093310

COc1cccc(NC(=O)OCCC(c2ccc(Cl)cc2)N(C)C)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.63
L3MBTL1 Q9Y468 1/20 0.49
MTNR1B P49286 1/20 0.49
HTT P42858 1/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
TRPV1 Q8NER1 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47

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
SCHEMBL6092762 0.87 UTS2R (0.60) UTS2RL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL6092440 0.84 UTS2R (0.62) UTS2RL3MBTL1MEN1KMT2AMAPT
SCHEMBL6091406 0.82 UTS2R (0.62) UTS2RL3MBTL1ALDH1A1CRHBPCRHR2
SCHEMBL6092713 0.78 UTS2R (0.61) UTS2RL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL5449690 0.77 UTS2R (1.00) UTS2R
SCHEMBL6094333 0.77 UTS2R (0.61) UTS2RL3MBTL1NPC1RAB9ACNR1
SCHEMBL6090694 0.76 UTS2R (0.60) UTS2RL3MBTL1HTTMEN1KMT2A
SCHEMBL5465628 0.74 UTS2R (0.64) UTS2RL3MBTL1HTTMEN1KMT2A
SCHEMBL6091970 0.73 UTS2R (0.59) UTS2RALDH1A1TP53CYP2C9CYP2C19
SCHEMBL6647977 0.71 MTNR1B (0.82) MTNR1BHTTMEN1KMT2AALDH1A1

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
WO-2006135694-A2 UII-MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2006-12-21 WO disclosed