SCHEMBL25135232

SCHEMBL25135232

Nc1cc(Oc2ccccc2N)cc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
RCE1 Q9Y256 1/20 0.50
ALDH1A1 P00352 4/20 0.47
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
IKBKB O14920 2/20 0.44
BRAF P15056 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
NLRP3 Q96P20 1/20 0.43
MAOA P21397 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 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
SCHEMBL8630463 0.85 GAA (0.60) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL5906230 0.82 GAA (0.64) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL3785169 0.82 MEN1 (0.63) GAAALDH1A1NCOA1NCOA3MEN1
SCHEMBL28993129 0.80 IKBKB (0.64) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL3684211 0.79 GAA (0.67) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL29392357 0.79 GAA (0.67) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL25135235 0.79 MEN1 (0.70) GAAALDH1A1NCOA1NCOA3MEN1
SCHEMBL30269590 0.78 ALDH1A1 (0.68) GAARCE1ALDH1A1NCOA1NCOA3
SCHEMBL11430946 0.77 MAOB (0.69) GAAALDH1A1MEN1NPC1RAB9A
SCHEMBL5744224 0.77 ALDH1A1 (0.66) GAARCE1ALDH1A1NCOA1NCOA3

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
WO-2023176172-A1 POLYIMIDE RESIN PRECURSOR 東京応化工業株式会社 2023-09-21 WO disclosed
WO-2023058385-A1 BLOCK COPOLYMER 東京応化工業株式会社 2023-04-13 WO disclosed