SCHEMBL27849554

SCHEMBL27849554

COc1ccnc(OC)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
SCN9A Q15858 1/20 0.40
ALDH1A1 P00352 1/20 0.39
DYRK1A Q13627 1/20 0.39
JAK2 O60674 1/20 0.38
G6PD P11413 1/20 0.38
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HASPIN Q8TF76 1/20 0.36
DYRK2 Q92630 1/20 0.36
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
RAB9A P51151 2/20 0.36
CCR4 P51679 1/20 0.36

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
SCHEMBL12557658 0.83 MAPK1 (0.37) MAPK1L3MBTL1MAPTKMT2ASCN9A
SCHEMBL30511916 0.81 MAPK1 (0.36) MAPK1L3MBTL1MAPTKMT2ASCN9A
SCHEMBL1662248 0.80 DYRK1A (0.40) MAPK1L3MBTL1MAPTKMT2AALDH1A1
SCHEMBL30320423 0.80 DYRK1A (0.40) MAPK1L3MBTL1MAPTKMT2AALDH1A1
SCHEMBL911419 0.80 CCR4 (0.43) MAPK1L3MBTL1MAPTKMT2ASCN9A
SCHEMBL12780743 0.79 CYP19A1 (0.48) MAPK1L3MBTL1MAPTKMT2AALDH1A1
SCHEMBL23624007 0.78 HASPIN (0.46) MAPK1L3MBTL1MAPTKMT2AALDH1A1
SCHEMBL5942324 0.78 DRD1 (0.39) MAPK1L3MBTL1MAPTKMT2AGAA
SCHEMBL3105493 0.78 DYRK1A (0.42) MAPK1L3MBTL1MAPTKMT2AALDH1A1
SCHEMBL23723810 0.77 ACACB (0.46) MAPK1L3MBTL1MAPTALDH1A1SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110325554-A Manufacturing method, modified conjugated diene polymer, rubber composition and the tire of modified conjugated diene polymer 株式会社普利司通 2019-10-11 CN disclosed
CN-105994322-B The Fungicidal composition and method of controlling plant diseases 石原产业株式会社 2019-03-08 CN disclosed
CN-109071685-A Terminal-modified conjugated diene polymer, rubber composition, and rubber article 株式会社普利司通 2018-12-21 CN disclosed
CN-105143216-B Antibacterial bis-aromatic derivative 爱杜西亚药品有限公司 2018-04-13 CN disclosed
CN-102333781-B Tricyclic pyrazolopyrimidine derivatives DAIICHI SANKYO CO LTD 2014-06-11 CN disclosed
CN-102333781-A Tricyclic pyrazolopyrimidine derivatives DAIICHI SANKYO CO LTD 2012-01-25 CN disclosed