SCHEMBL10816283

SCHEMBL10816283

C=CC(=O)NCCCCOc1ccc2ccccc2c1-c1c(OCCCCNC(=O)C=C)ccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 12/20 0.47
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ MTNR1A P48039 1/20 0.42
▸ MTNR1B P49286 1/20 0.42
▸ ITK Q08881 1/20 0.41
▸ NCEH1 Q6PIU2 1/20 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
SCHEMBL10364770 0.94 TGM2 (0.43) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10364143 0.88 NCEH1 (0.53) TGM2ALDH1A1HPGDNCEH1
SCHEMBL10363163 0.87 SLC6A4 (0.58) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10362461 0.87 L3MBTL1 (0.58) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10804531 0.87 TGM2 (0.52) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL11021590 0.86 SLC6A4 (0.57) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10804128 0.85 TGM2 (0.46) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10364184 0.84 NCEH1 (0.49) TGM2KDM4EALDH1A1HPGDSLC6A4
SCHEMBL10803446 0.82 TGM2 (0.56) TGM2KDM4EALDH1A1MTNR1AMTNR1B
SCHEMBL10803651 0.82 TGM2 (0.46) TGM2

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
US-4649219-A CROSSLINKERS, ADHESIVES, PAINTS MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1987-03-10 — — US disclosed
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