SCHEMBL13069072

SCHEMBL13069072

C=C(N)Cc1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.48
IDO1 P14902 5/20 0.47
TAAR1 Q96RJ0 1/20 0.44
GAA P10253 1/20 0.44
AGXT P21549 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTBP2 P56545 1/20 0.42
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
MAPK8 P45983 1/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39

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
SCHEMBL21699087 0.80 GAA (0.47) LOXL2IDO1TAAR1GAAAGXT
SCHEMBL23891925 0.78 ABAT (0.50) LOXL2TAAR1
SCHEMBL8337513 0.78 CTBP2 (0.48) LOXL2IDO1TAAR1GAAAGXT
SCHEMBL10535299 0.78 CA2 (0.60) IDO1TAAR1CTBP2TDP1ALDH1A1
SCHEMBL9256936 0.78 ALDH1A1 (0.48) LOXL2GAAMAOAMAOBPOLB
SCHEMBL13349456 0.77 TAAR1 (0.52) LOXL2IDO1TAAR1AGXTMAOA
SCHEMBL328637 0.76 CA2 (0.64) LOXL2GAASMN1; SMN2CTBP2MAPK8
SCHEMBL183375 0.76 IDO1 (0.57) LOXL2IDO1TAAR1GAAAGXT
SCHEMBL8033735 0.76 CA2 (0.37)
SCHEMBL8271141 0.76 TDP1 (0.48) LOXL2IDO1TAAR1GAASMN1; SMN2

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
EP-4249480-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Northwest A&F University (CN) 2023-09-27 EP disclosed
EP-1585522-B1 QUINAZOLINONES AS POTASSIUM CHANNEL MODULATORS ICAGEN INC (US) 2010-11-17 EP disclosed