SCHEMBL22756167

SCHEMBL22756167

CCc1ccc(C(=O)N[C@@H](Cc2ccc(-c3ncc(-c4ccc(C(C)(C)C)cc4)cn3)cc2)C(O)O)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ GRIN2C Q14957 1/20 0.36
▸ NPC1 O15118 4/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ DGAT1 O75907 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 3/20 0.34
▸ MME P08473 2/20 0.34
▸ SMYD3 Q9H7B4 1/20 0.34
▸ GCGR P47871 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ COPS5 Q92905 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ NR1H4 Q96RI1 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL22449271 0.87 KIFC1 (0.44) KDM4EGRIN2CDGAT1MME
SCHEMBL15037185 0.87 KIFC1 (0.44) KDM4EGRIN2CDGAT1MME
SCHEMBL22448956 0.82 L3MBTL1 (0.45) LMNARAB9AMMEGCGR
SCHEMBL22384107 0.78 RARB (0.39) KDM4ENPC1RAB9A
SCHEMBL22449182 0.76 MME (0.36) KDM4EGAANPC1KMT2ADGAT1
SCHEMBL22449139 0.76 MME (0.36) KDM4EGAANPC1KMT2ADGAT1
SCHEMBL17968745 0.76 KIFC1 (0.43) KDM4EDGAT1MAPTMMEALDH1A1
SCHEMBL15037392 0.76 KIFC1 (0.43) KDM4EDGAT1MAPTMMEALDH1A1
SCHEMBL17834867 0.76 KIFC1 (0.43) KDM4EDGAT1MAPTMMEALDH1A1
SCHEMBL15037133 0.76 KIFC1 (0.43) KDM4EDGAT1MAPTMMEALDH1A1

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-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — EP disclosed
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