SCHEMBL28257375

SCHEMBL28257375

CC(NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.61
▸ MAPT P10636 3/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ ALDH1A1 P00352 6/20 0.61
▸ KCNB1 Q14721 1/20 0.61
▸ KCNB2 Q92953 1/20 0.61
▸ PHGDH O43175 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ CRHBP P24387 1/20 0.49
▸ CRHR2 Q13324 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ POLB P06746 1/20 0.47

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
SCHEMBL28411034 0.91 LMNA (0.61) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL27656657 0.85 LMNA (0.64) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL27656560 0.85 LMNA (0.64) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL28406386 0.85 ALDH1A1 (0.49) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL31546660 0.84 LMNA (0.63) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL28408448 0.83 ALDH1A1 (0.52) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL28890744 0.82 ALDH1A1 (0.51) MEN1KMT2AALDH1A1
SCHEMBL31546635 0.82 ALDH1A1 (0.64) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL28406352 0.81 MAPT (0.48) LMNAMAPTMEN1KMT2AALDH1A1
SCHEMBL28257377 0.80 KCNB1 (0.52) LMNAMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108929263-B Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2022-07-22 — — CN disclosed
CN-111108092-A Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2020-05-05 — — CN disclosed
CN-108929263-A Aryl amide Kv2.1 inhibitor and preparation method thereof, pharmaceutical composition and purposes 中国医学科学院药物研究所 2018-12-04 — — CN disclosed
Send feedback