SCHEMBL27845650

SCHEMBL27845650

COc1ccc(CN=[N+]=[N-])cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ KMT2A Q03164 5/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ HSD17B10 Q99714 1/20 0.46
▸ TTR P02766 1/20 0.43
▸ MAPT P10636 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ KDM1A O60341 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ GFER P55789 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
SCHEMBL21796409 0.87 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL23070508 0.85 CA2 (0.55) SMN1; SMN2ALDH1A1POLBLMNACA2
SCHEMBL18986802 0.81 L3MBTL1 (0.49) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL19197654 0.80 SMN1; SMN2 (0.58) SMN1; SMN2KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL13845056 0.79 IDO1 (0.47) SMN1; SMN2POLB
SCHEMBL30613375 0.79 IDO1 (0.47) SMN1; SMN2POLB
SCHEMBL17283061 0.78 SMN1; SMN2 (0.56) SMN1; SMN2KMT2AMEN1ALDH1A1HSD17B10
SCHEMBL28012438 0.78 LMNA (0.43) SMN1; SMN2KMT2AMEN1HPGDNPSR1
SCHEMBL17913311 0.77 ALDH1A1 (0.39) ALDH1A1POLBMAPK1GAACA2
SCHEMBL28393608 0.76 CA2 (0.41) ALDH1A1POLBCA2

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
CN-102372697-A Substituted miazines compound KBP BIOSCIENCES CO LTD 2012-03-14 — — CN disclosed
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