SCHEMBL25535335

SCHEMBL25535335

CCNc1cc(C(c2ccc(Nc3ccccc3)c(N)c2)(C(F)(F)F)C(F)(F)F)ccc1Nc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 14/20 0.59
MAPT P10636 12/20 0.59
KDM4E B2RXH2 10/20 0.59
ALDH1A1 P00352 9/20 0.59
GFER P55789 5/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
HPGD P15428 4/20 0.40
THRB P10828 2/20 0.40
HSD17B10 Q99714 2/20 0.40
SMN1; SMN2 Q16637 5/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 3/20 0.37
PLEC Q15149 1/20 0.37

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
SCHEMBL376200 0.87 GAA (0.77) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL29708495 0.87 GAA (0.77) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL29540467 0.87 GAA (0.77) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL25533949 0.86 GAA (0.63) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL23057879 0.83 GAA (0.67) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL376030 0.83 MAPT (0.47) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL29540627 0.83 MAPT (0.47) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL10068514 0.82 GAA (0.65) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL29049650 0.80 GAA (0.52) GAAMAPTKDM4EALDH1A1GFER
SCHEMBL25536037 0.77 RXFP1 (0.45) MAPTKMT2ACYP1A2HTTNPC1

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
US-11655339-B2 Polybenzimidazole, precursor polyamide thereof, and method for producing same DAIKIN INDUSTRIES, LTD. (JP) 2023-05-23 US disclosed