SCHEMBL22109657

SCHEMBL22109657

Cc1ccc(Oc2ccc(ON)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.65
ALDH1A1 P00352 4/20 0.62
TDP1 Q9NUW8 4/20 0.62
POLB P06746 1/20 0.62
MAPT P10636 1/20 0.62
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
ACHE P22303 2/20 0.48
HTT P42858 2/20 0.45
MMP13 P45452 1/20 0.45
CYP3A4 P08684 2/20 0.43
TSHR P16473 2/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
AGXT P21549 1/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL6203435 0.92
Hydrochloric Acid SCHEMBL7227036 0.89 TDP1 (0.54) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL83814 0.86 TEAD4 (0.74) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL83863 0.86 TEAD4 (0.74) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL95343 0.86 TEAD4 (0.74) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL27251880 0.84 ACHE (0.48) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL27251901 0.84 ACHE (0.48) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL19190824 0.84 ALDH1A1 (0.59) TEAD4ALDH1A1TDP1POLBMAPT
SCHEMBL29377968 0.83 TEAD4 (0.70) TEAD4ALDH1A1TDP1POLBMAPT
Phosphine SCHEMBL22361928 0.83 TEAD4 (0.70) TEAD4ALDH1A1TDP1POLBMAPT

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
WO-2020121979-A1 LIQUID-CRYSTAL ALIGNMENT AGENT, LIQUID-CRYSTAL ALIGNMENT FILM, AND LIQUID-CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2020-06-18 WO disclosed