SCHEMBL8342841

SCHEMBL8342841

NC(=O)C1C=Cc2ccccc2N1C(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.65
▸ MEN1 O00255 4/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ TSHR P16473 2/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ NPSR1 Q6W5P4 2/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ P2RX4 Q99571 5/20 0.51
▸ LMNA P02545 6/20 0.46
▸ SCN4A P35499 1/20 0.42
▸ SCN5A Q14524 1/20 0.42
▸ SCN9A Q15858 1/20 0.42
▸ POLB P06746 1/20 0.36
▸ BCHE P06276 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ ATM Q13315 2/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL8346200 0.89 MEN1 (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8341199 0.87 MEN1 (0.64) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8342341 0.86 MEN1 (0.49) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8346666 0.84 SMN1; SMN2 (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8341195 0.81 KMT2A (0.59) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL27890245 0.79 MEN1 (1.00) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8343102 0.78 MEN1 (0.52) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8342494 0.75 LMNA (0.75) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL8340574 0.75 MEN1 (0.49) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR
SCHEMBL30434844 0.73 MEN1 (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1TSHR

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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