SCHEMBL8569303

SCHEMBL8569303

O=C(c1ccccc1)c1cccnc1NC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.50
HTT P42858 2/20 0.49
RAB9A P51151 4/20 0.48
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
ATM Q13315 1/20 0.42
MAPK1 P28482 1/20 0.42
AKR1C3 P42330 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
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
SCHEMBL8695054 0.86 DHODH (0.50) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL9842635 0.82 RAB9A (0.68) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL8693733 0.79 DHODH (0.57) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL8569129 0.77 ALDH1A1 (0.62) HTTALDH1A1KMT2AMEN1GAA
SCHEMBL21847164 0.77 RAB9A (0.46) DHODHRAB9ANPC1ALDH1A1KMT2A
SCHEMBL8691797 0.77 DHODH (0.52) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL8694084 0.76 DHODH (0.76) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL27332905 0.75 HTT (0.53) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL30168625 0.74 DHODH (0.50) DHODHHTTRAB9ANPC1ALDH1A1
SCHEMBL3408423 0.74 CYP1A2 (0.49) HTTRAB9ANPC1ALDH1A1KMT2A

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
EP-0626373-B1 Quinazolinone derivatives SUMITOMO PHARMA (JP) 1998-12-23 EP disclosed
US-5556860-A ANTIISCHEMIC AGENTS, BRAIN DISORDERS AND BLOOD METAL CONCENTRATIONS AND KIDNEY DISEASE SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1996-09-17 US disclosed
EP-0626373-A1 Quinazolinone derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-30 EP disclosed