SCHEMBL7683976

SCHEMBL7683976

Cc1coc2c1C(=O)CC(c1ccccc1F)C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP1LC3B Q9GZQ8 2/20 0.41
LMNA P02545 2/20 0.39
KDM1A O60341 2/20 0.37
KDM1B Q8NB78 1/20 0.37
TERT O14746 1/20 0.36
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
USP2 O75604 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL7681124 0.87 MAP1LC3B (0.42) MAP1LC3BLMNAALDH1A1KDM4EMAPT
SCHEMBL7687099 0.84 TP53 (0.35)
SCHEMBL7683611 0.84 MAP1LC3B (0.49) MAP1LC3BLMNAKDM1AALDH1A1MAPK1
SCHEMBL7689638 0.84 TP53 (0.48) MAP1LC3BLMNAALDH1A1KDM4EMAPT
SCHEMBL7680946 0.83 HTR2C (0.40) LMNAMAPT
SCHEMBL7680888 0.82 MAP1LC3B (0.51) MAP1LC3BLMNAALDH1A1KDM4EMAPT
SCHEMBL7685368 0.80 LMNA (0.58) MAP1LC3BLMNAALDH1A1KDM4EGAA
SCHEMBL7683942 0.79 MAP1LC3B (0.44) MAP1LC3BLMNAALDH1A1KDM4ETSHR
SCHEMBL7689326 0.77 GRM7 (0.42) LMNATERTALDH1A1KDM4EHSD17B10
SCHEMBL7690067 0.75 MAP1LC3B (0.38) MAP1LC3BLMNAALDH1A1KDM4EMAPT

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-6350749-B1 SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-26 US disclosed
EP-1057812-A1 AMINOGUANIDINE HYDRAZONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-12-06 EP disclosed