SCHEMBL2707642

SCHEMBL2707642

CNCC(=O)N1CCCC1c1cc(C(=O)O)c(C)s1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 4/20 0.38
CPT1A P50416 3/20 0.36
CPT2 P23786 2/20 0.36
CPT1B Q92523 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PPID Q08752 2/20 0.35
POLB P06746 1/20 0.34
PREP P48147 3/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
PPIG Q13427 1/20 0.32
DPP4 P27487 2/20 0.32
FAP Q12884 1/20 0.32
ACE P12821 1/20 0.32

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
SCHEMBL2709286 0.88 PPID (0.39) AADATCPT1ACPT2CPT1BPPID
SCHEMBL2708134 0.86 MEN1 (0.40) AADATCPT1ACPT2CPT1BNPC1
SCHEMBL2724717 0.84 NPC1 (0.37) AADATCPT1ACPT2CPT1BNPC1
SCHEMBL2139189 0.80 AHR (0.42) AADATNPC1RAB9A
SCHEMBL2708567 0.78 DPP4 (0.42) AADATNPC1RAB9APOLBPREP
SCHEMBL2138294 0.69 MAOA (0.35) AADATPREPDPP4FAP
SCHEMBL2139572 0.69 AHR (0.40) AADATPREP
SCHEMBL2137255 0.69 NPSR1 (0.43) NPC1ALDH1A1
SCHEMBL2139149 0.69 MAOA (0.37) AADATNPC1RAB9A
SCHEMBL7364621 0.68 ACE (0.62) RAB9AACE

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-2447265-A1 NOVEL THIOPHENE CARBOXAMIDE DERIVATIVE AND MEDICINAL USE OF SAME Sanwa Kagaku Kenkyusho Co., Ltd (JP) 2012-05-02 EP disclosed