SCHEMBL8700223

SCHEMBL8700223

NC(=NC(=O)c1ccccc1)Nn1cccc1/C=N/O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.42
▸ POLB P06746 4/20 0.42
▸ RECQL P46063 4/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ APEX1 P27695 2/20 0.42
▸ CTDSP1 Q9GZU7 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ NSD2 O96028 1/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ PTPN7 P35236 1/20 0.42
▸ LMNA P02545 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8701523 1.00 MAPT (0.42) MAPTPOLBRECQLTDP1L3MBTL1
Hydrochloric Acid SCHEMBL8700510 0.99 MAPT (0.41) MAPTPOLBRECQLTDP1L3MBTL1
Hydrochloric Acid SCHEMBL8699955 0.99 MAPT (0.41) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL8706114 0.79 CYP1A2 (0.39) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL8705201 0.75 CYP1A2 (0.36) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL8700219 0.74 MAPT (0.42) MAPTPOLBRECQLTDP1L3MBTL1
Hydrochloric Acid SCHEMBL8699950 0.73 MAPT (0.41) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL1389017 0.66 POLB (0.70) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL1389018 0.66 POLB (0.70) MAPTPOLBRECQLTDP1L3MBTL1
SCHEMBL7825568 0.66 POLB (0.70) MAPTPOLBRECQLTDP1L3MBTL1

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
US-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 — — US disclosed
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