SCHEMBL6628850

SCHEMBL6628850

O=C(Cl)Oc1ccnnc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.42
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.30

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
SCHEMBL185926 0.81 HCAR2 (0.48) HCAR2HSD17B10ALOX15KMT2ALOXL2
SCHEMBL27972799 0.79 LMNA (0.47) HCAR2HSD17B10KMT2AMAPTKDM4E
SCHEMBL27950383 0.79 HCAR2 (0.42) HCAR2HSD17B10ALOX15KMT2ALOXL2
SCHEMBL13134217 0.76 THRB (0.42) HCAR2HSD17B10ALOX15KMT2AMAPT
SCHEMBL5170271 0.76 HSD17B10 (0.54) HSD17B10KMT2AMAPTKDM4EALDH1A1
Hydrochloric Acid SCHEMBL10772752 0.74 HSD17B10 (0.52) HSD17B10ALOX15KMT2AMAPTKDM4E
SCHEMBL1532656 0.73 KMT2A (0.58) HCAR2HSD17B10ALOX15KMT2AMAPT
SCHEMBL27455859 0.73 KMT2A (0.50) HCAR2HSD17B10ALOX15KMT2AMAPT
Hydrochloric Acid SCHEMBL10604528 0.72 KMT2A (0.61) HSD17B10ALOX15KMT2AMAPTKDM4E
SCHEMBL6924446 0.71 RAB9A (0.46) HSD17B10KMT2AMAPTALDH1A1

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-1456210-A1 PYRAZOLYL-SUBSTITUTED TRIAZOLOQUINOXALINES JSW-Research Forschungslabor Gmbh (AT) 2004-09-15 EP disclosed
WO-2003053973-A1 PYRAZOLYL-SUBSTITUTED TRIAZOLOQUINOXALINES JSW-RESEARCH FORSCHUNGSLABOR GMBH (AT) 2003-07-03 WO disclosed
EP-0088997-A1 Process for producing burning-out effects on textile materials CASSELLA Aktiengesellschaft (DE) 1983-09-21 EP disclosed