SCHEMBL11784681

SCHEMBL11784681

C=CCNC(=O)c1ccc2c(c1)C(=O)NC2=O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.53
▸ KMT2A Q03164 6/20 0.52
▸ HPGD P15428 5/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ PKM P14618 2/20 0.52
▸ CASP3 P42574 1/20 0.52
▸ LMNA P02545 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CYP1A2 P05177 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ TERT O14746 2/20 0.42

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
SCHEMBL18159011 0.80 TERT (0.53) RAB9AKMT2AHPGDMEN1LMNA
SCHEMBL11348681 0.80 KMT2A (0.51) KMT2AHPGDMEN1CASP3ALDH1A1
SCHEMBL18129455 0.79 PTPRC (0.59) RAB9AKMT2AHPGDMEN1PKM
SCHEMBL11348981 0.78 KMT2A (0.52) KMT2AHPGDMEN1CASP3ALDH1A1
SCHEMBL2385213 0.77 HPGD (0.76) RAB9AKMT2AHPGDMEN1PKM
SCHEMBL28854788 0.77 PTPRC (0.49) KMT2AMEN1CASP3CTDSP1TERT
SCHEMBL7943849 0.77 HPGD (0.48) RAB9AKMT2AHPGDMEN1CASP3
SCHEMBL11078513 0.76 L3MBTL1 (0.49) RAB9AKMT2AHPGDMEN1PKM
SCHEMBL9426481 0.76 PKM (0.63) RAB9AKMT2AHPGDMEN1PKM
SCHEMBL11346483 0.75 SMN1; SMN2 (0.59) KMT2AHPGDMEN1ALDH1A1SMN1; SMN2

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
JP-52077192-A — — None — — JP disclosed
JP-S5277192-A PREPARATION OF THERMOSETTING ALLYL TRIMELLITAMIDEIMIDE RESINS TEIJIN LTD 1977-06-29 — — JP disclosed
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