SCHEMBL28337055

SCHEMBL28337055

Nc1ccc(NC(=O)c2ccc(N)c(C(F)(F)F)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.66
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
LMNA P02545 3/20 0.60
POLB P06746 2/20 0.60
PKM P14618 1/20 0.60
APEX1 P27695 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
BRAF P15056 5/20 0.54
HDAC1 Q13547 4/20 0.54
HDAC3 O15379 3/20 0.54
HDAC4 P56524 3/20 0.54
HDAC7 Q8WUI4 3/20 0.54
HDAC2 Q92769 3/20 0.54
HDAC10 Q969S8 3/20 0.54
HDAC11 Q96DB2 3/20 0.54
HDAC8 Q9BY41 3/20 0.54
HDAC6 Q9UBN7 3/20 0.54
HDAC9 Q9UKV0 3/20 0.54
HDAC5 Q9UQL6 3/20 0.54

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
SCHEMBL14972641 0.91 PTGS1 (0.66) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL24203624 0.87 BRAF (0.51) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL26416635 0.86 MAPT (0.62) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL20468346 0.85 PTGS1 (0.59) PTGS1MEN1KMT2ALMNAMAPT
SCHEMBL20468348 0.82 PTGS1 (0.64) PTGS1MEN1KMT2ALMNAMAPT
SCHEMBL28895734 0.81 MAPT (0.57) PTGS1MEN1KMT2ALMNAPOLB
SCHEMBL20468345 0.81 PTGS1 (0.59) PTGS1MAPT
SCHEMBL20468343 0.81 PTGS1 (0.47) PTGS1MEN1KMT2ALMNABRAF
SCHEMBL5866977 0.80 FADS1 (0.58) PTGS1MAPTNPC1RAB9A
SCHEMBL7190381 0.80 PTGS1 (0.41) PTGS1LMNAPOLBMAPTHTT

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-110628025-B Polyimide precursor, polyimide, and material for use in production thereof 宇部兴产株式会社 2022-07-12 CN disclosed
CN-110628025-A Polyimide precursor, polyimide, and material for use in preparation thereof 宇部兴产株式会社 2019-12-31 CN disclosed