SCHEMBL20195609

SCHEMBL20195609

CCOc1cccc(C(=O)O)c1COc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
HTT P42858 2/20 0.51
RXFP1 Q9HBX9 2/20 0.46
MRGPRX4 Q96LA9 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
GLA P06280 1/20 0.42
HCRTR1 O43613 2/20 0.42
GABRA5 P31644 1/20 0.41
APEX1 P27695 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
MAPT P10636 1/20 0.39
HPGD P15428 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
SCHEMBL20195529 0.88 HTT (0.46) MEN1KMT2AHTTMRGPRX4GABRA5
SCHEMBL20195590 0.84 GABRA5 (0.44) MEN1KMT2AHTTMRGPRX4LMNA
SCHEMBL20195549 0.81 ALDH1A1 (0.51) MEN1KMT2AHTTRXFP1MRGPRX4
SCHEMBL20195598 0.80 KMT2A (0.49) MEN1KMT2AHTTRXFP1L3MBTL1
SCHEMBL18504621 0.79 HTT (0.40) MEN1KMT2AHTTMRGPRX4LMNA
SCHEMBL22564474 0.78 HTT (0.40) MEN1KMT2AHTTMRGPRX4LMNA
SCHEMBL1989711 0.77 L3MBTL1 (0.50) MEN1KMT2AHTTMRGPRX4LMNA
SCHEMBL20195668 0.77 RAB9A (0.44) MEN1KMT2ALMNAGABRA5ALDH1A1
SCHEMBL20195452 0.76 GABRA5 (0.39) MEN1KMT2AL3MBTL1HCRTR1GABRA5
SCHEMBL20195550 0.76 ALDH1A1 (0.49) MEN1KMT2AHTTRXFP1LMNA

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
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed