SCHEMBL27899038

SCHEMBL27899038

CC(CC(C(N)=O)N1Cc2c(O)cccc2C1=O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ SDCBP O00560 7/20 0.38
▸ SDC2 P34741 7/20 0.38
▸ POLB P06746 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ THRB P10828 1/20 0.37
▸ STAT3 P40763 1/20 0.35
▸ CRBN Q96SW2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ XIAP P98170 1/20 0.34
▸ HKDC1 Q2TB90 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL19222240 0.83 ALOX15 (0.39) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL27881767 0.83 SDCBP (0.35) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL20425363 0.81 KDM4E (0.45) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL2257304 0.81 KDM4E (0.45) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL20766605 0.81 ALOX15 (0.45) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL20766604 0.81 ALOX15 (0.45) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL25907886 0.80 ALOX15 (0.37) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL17343919 0.80 ALOX15 (0.37) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL2250406 0.79 MEN1 (0.48) ALOX15MAPTSMN1; SMN2KDM4ESDCBP
SCHEMBL27899007 0.78 HTT (0.40) MAPTSMN1; SMN2KDM4ESDCBPSDC2

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
CN-102822165-A Arylmethoxy isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORP 2012-12-12 — — CN disclosed
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