SCHEMBL8716567

SCHEMBL8716567

CC(=O)Nc1cccc(C(=O)N(CCN2CCC(C(=O)c3ccc(F)cc3)CC2)c2ccc(F)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
HTR1F P30939 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 2/20 0.49
HTR2A P28223 2/20 0.47
HTR2C P28335 2/20 0.47
HTR7 P34969 2/20 0.47
HTR6 P50406 2/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD11B1 P28845 1/20 0.46

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
SCHEMBL8711150 0.97 MEN1 (0.53) MEN1KMT2AHTR1FSMN1; SMN2LMNA
SCHEMBL8710932 0.96 MEN1 (0.55) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL8712490 0.95 MEN1 (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL8712491 0.95 MEN1 (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL9233858 0.93 MEN1 (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL9233869 0.93 MEN1 (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL9230029 0.92 MEN1 (0.49) MEN1KMT2AHTR1FSMN1; SMN2LMNA
Fumaric Acid SCHEMBL9230021 0.92 MEN1 (0.49) MEN1KMT2AHTR1FSMN1; SMN2LMNA
SCHEMBL8710697 0.90 SMN1; SMN2 (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA
SCHEMBL8710884 0.90 HTR1F (0.51) MEN1KMT2AHTR1FSMN1; SMN2LMNA

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-5728835-A HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS TOA EIYO, LTD. (JP) 1998-03-17 US disclosed
EP-0661266-A1 Substituted cyclic amine compounds as 5HT2 antagonists TOA EIYO LTD. (JP) 1995-07-05 EP disclosed