SCHEMBL8341195

SCHEMBL8341195

N=C(NO)C1C=Cc2ccccc2N1C(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ SMN1; SMN2 Q16637 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ P2RX4 Q99571 4/20 0.47
▸ LMNA P02545 5/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ ATM Q13315 2/20 0.33
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ P2RY1 P47900 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ CA12 O43570 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
SCHEMBL8343101 0.90 MEN1 (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8340571 0.87 MEN1 (0.45) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8342841 0.81 KMT2A (0.65) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8341199 0.77 MEN1 (0.64) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL27890245 0.75 MEN1 (1.00) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8342494 0.71 LMNA (0.75) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8346200 0.71 MEN1 (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL30434844 0.69 MEN1 (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL15365273 0.69 MEN1 (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1
SCHEMBL8343102 0.68 MEN1 (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1NPSR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939435-A TREATMENT OF ATHEROSCLEROSIS AND CORONARY HEART DISEASE AMERICAN HOME PRODUCTS CORPORATION (US) 1999-08-17 — — US claimed
US-5939435-A TREATMENT OF ATHEROSCLEROSIS AND CORONARY HEART DISEASE AMERICAN HOME PRODUCTS CORPORATION (US) 1999-08-17 — — US disclosed
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