SCHEMBL30341891

SCHEMBL30341891

COc1ccc(C(=O)c2cc(N)ccc2-c2ccc(N)cc2C(=O)c2ccc(OC)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 1/20 0.56
KMT2A Q03164 3/20 0.53
MAPT P10636 4/20 0.53
HTT P42858 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
GAA P10253 2/20 0.52
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HPGD P15428 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
PARP1 P09874 1/20 0.49
PARP10 Q53GL7 1/20 0.49
PARP2 Q9UGN5 1/20 0.49
PARP4 Q9UKK3 1/20 0.49

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
SCHEMBL28426167 0.91 SMN1; SMN2 (0.54) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL30286802 0.88 NPC1 (0.52) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL28139091 0.86 MAPT (0.73) RAB9ANPC1ALDH1A1KMT2AMAPT
SCHEMBL3767491 0.86 NPC1 (0.54) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL30286402 0.84 NPC1 (0.50) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL30341892 0.81 MAPT (0.54) RAB9ANPC1ALDH1A1KMT2AMAPT
SCHEMBL30574108 0.81 MAPT (0.73) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL11711133 0.81 MAPT (0.73) RAB9ANPC1ALDH1A1KDM4EKMT2A
SCHEMBL1872764 0.81 MAPK1 (0.67) RAB9ANPC1ALDH1A1KMT2AMAPT
SCHEMBL5141691 0.81 MAPK1 (0.67) RAB9ANPC1ALDH1A1KMT2AMAPT

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
CN-111303417-B Photocrosslinkable polyimide resin 上海极紫科技有限公司 2023-03-21 CN claimed
CN-111303417-B Photocrosslinkable polyimide resin 上海极紫科技有限公司 2023-03-21 CN disclosed