SCHEMBL4299166

SCHEMBL4299166

C[C@H](NC(=O)[C@H](C)Nc1ccc2ccccc2c1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ GAA P10253 1/20 0.47
▸ EPHX1 P07099 1/20 0.46
▸ RECQL P46063 1/20 0.44
▸ MAPT P10636 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ TP53 P04637 2/20 0.42
▸ CYP1A2 P05177 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CYP2C19 P33261 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ POLB P06746 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ CYP2D6 P10635 3/20 0.41

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
SCHEMBL8509186 0.83 RAB9A (0.53) RAB9ASMN1; SMN2GAARECQLMAPT
SCHEMBL8509187 0.83 RAB9A (0.53) RAB9ASMN1; SMN2GAARECQLMAPT
SCHEMBL29687055 0.81 RAB9A (0.58) RAB9ASMN1; SMN2GAAEPHX1RECQL
SCHEMBL6875755 0.81 RAB9A (0.58) RAB9ASMN1; SMN2GAAEPHX1RECQL
SCHEMBL454293 0.79 RECQL (0.58) RAB9ASMN1; SMN2GAARECQLMAPT
SCHEMBL454294 0.79 RECQL (0.58) RAB9ASMN1; SMN2GAARECQLMAPT
SCHEMBL43517 0.79 RAB9A (0.54) RAB9ASMN1; SMN2GAAMAPTLMNA
SCHEMBL43518 0.79 RAB9A (0.54) RAB9ASMN1; SMN2GAAMAPTLMNA
SCHEMBL29478375 0.79 RAB9A (0.54) RAB9ASMN1; SMN2GAAMAPTLMNA
SCHEMBL288854 0.79 RAB9A (0.54) RAB9ASMN1; SMN2GAAMAPTLMNA

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
EP-2276776-B1 METHOD AND AFFINITY COLUMN FOR PURIFYING PROTEINS SAMSUNG ELECTRONICS CO LTD (KR) 2015-07-29 — — EP disclosed
US-20090286283-A1 METHOD AND AFFINITY COLUMN FOR PURIFYING PROTEINS SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-11-19 — — US disclosed
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