SCHEMBL29569367

SCHEMBL29569367

COc1ccc(C)c(N)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
MAPT P10636 3/20 0.59
MEN1 O00255 2/20 0.59
THRB P10828 2/20 0.59
KMT2A Q03164 2/20 0.59
TDP1 Q9NUW8 5/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
KDM4E B2RXH2 1/20 0.57
GAA P10253 1/20 0.57
RECQL P46063 1/20 0.57
BLM P54132 1/20 0.57
MCL1 Q07820 1/20 0.57
CYP3A4 P08684 4/20 0.54
CASP1 P29466 1/20 0.52
MAPK1 P28482 1/20 0.48
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46

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
SCHEMBL55593 1.00 ALDH1A1 (0.59) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL8167265 0.83 NR4A1 (0.61) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL375549 0.83 DYRK1A (0.53) ALDH1A1TDP1SMN1; SMN2CYP3A4CASP1
SCHEMBL29568160 0.81 ALDH1A1 (0.59) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL91981 0.81 ALDH1A1 (0.59) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL29387850 0.80 ALDH1A1 (0.64) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL234263 0.80 ALDH1A1 (0.64) ALDH1A1MAPTMEN1THRBKMT2A
SCHEMBL25947189 0.80 MAOB (0.56) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL31713018 0.79 ALDH1A1 (0.50) ALDH1A1MAPTMEN1THRBKMT2A
Hydrochloric Acid SCHEMBL8946354 0.79 ALDH1A1 (0.63) ALDH1A1MAPTMEN1THRBKMT2A

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-108389512-B Laminate, flexible device, and method for producing laminate 东京应化工业株式会社 2022-04-15 CN disclosed