SCHEMBL28645534

SCHEMBL28645534

Nc1ccc(C2(N)C=CC=CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.31
OPRK1 P41145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP19A1 P11511 4/20 0.31
NSD2 O96028 1/20 0.31

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
Methane SCHEMBL28540585 0.98 ALDH1A1 (0.36) ALDH1A1L3MBTL1LMNAMEN1MAPT
SCHEMBL29187565 0.82 CYP2A6 (0.32) ALDH1A1
SCHEMBL8039521 0.81 PNMT (0.39)
SCHEMBL31325937 0.80
SCHEMBL30149514 0.79 ALDH1A1 (0.38) ALDH1A1L3MBTL1LMNAMEN1MAPT
SCHEMBL8107886 0.77 ALDH1A1 (0.39) ALDH1A1L3MBTL1LMNAMEN1MAPT
SCHEMBL9666259 0.76 ALDH1A1 (0.35) ALDH1A1L3MBTL1LMNAMEN1MAPT
SCHEMBL28650824 0.74 SLC6A4 (0.43)
SCHEMBL9578203 0.71 ALDH1A1 (0.47) ALDH1A1L3MBTL1MEN1MAPTKMT2A
SCHEMBL28649220 0.71 CHRM2 (0.34) ALDH1A1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457338-B Polymer composition, liquid crystal aligning agent, resin film, liquid crystal aligning film, method for producing liquid crystal display element, and liquid crystal display element 日产化学株式会社 2024-09-24 CN disclosed
CN-116457338-A Polymer composition, liquid crystal aligning agent, resin film, liquid crystal aligning film, method for producing liquid crystal display element, and liquid crystal display element 日产化学株式会社 2023-07-18 CN disclosed
CN-113396359-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element using same 日产化学株式会社 2021-09-14 CN disclosed