SCHEMBL8341199

SCHEMBL8341199

NC(=NO)C1C=Cc2ccccc2N1C(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.64
▸ KMT2A Q03164 3/20 0.64
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ CYP2C19 P33261 2/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ P2RX4 Q99571 2/20 0.51
▸ LMNA P02545 6/20 0.44
▸ SCN4A P35499 1/20 0.40
▸ SCN5A Q14524 1/20 0.40
▸ SCN9A Q15858 1/20 0.40
▸ GAA P10253 1/20 0.37
▸ BCHE P06276 2/20 0.37
▸ ACHE P22303 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL8343102 0.90 MEN1 (0.52) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8342841 0.87 KMT2A (0.65) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8340574 0.87 MEN1 (0.49) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL27890245 0.79 MEN1 (1.00) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8346200 0.77 MEN1 (0.52) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8341195 0.77 KMT2A (0.59) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8342341 0.74 MEN1 (0.49) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8346666 0.73 SMN1; SMN2 (0.50) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL8342494 0.72 LMNA (0.75) MEN1KMT2ASMN1; SMN2ALDH1A1TSHR
SCHEMBL30434844 0.70 MEN1 (0.53) MEN1KMT2ASMN1; 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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