SCHEMBL8666356

SCHEMBL8666356

CC(C)CNC(=O)C1CC(C(=O)O)C(c2ccccc2F)N1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
KMT2A Q03164 6/20 0.39
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 3/20 0.38
MAPT P10636 1/20 0.38
SLC6A2 P23975 1/20 0.36
CACNA1G O43497 1/20 0.34
HPGD P15428 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
GPR88 Q9GZN0 1/20 0.33
HDAC4 P56524 2/20 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
SCHEMBL8666854 0.82 LMNA (0.37) LMNATAAR1KMT2AALDH1A1L3MBTL1
SCHEMBL8683686 0.81 LMNA (0.38) LMNAKMT2AALDH1A1L3MBTL1MEN1
SCHEMBL8668679 0.80 MEN1 (0.43) LMNAKMT2AALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL8672045 0.79 MEN1 (0.42) LMNAKMT2AALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL8683766 0.77 REN (0.38) LMNAKMT2AALDH1A1L3MBTL1MEN1
SCHEMBL8683956 0.77 POLB (0.36) LMNAKMT2AALDH1A1L3MBTL1MEN1
SCHEMBL8684040 0.75 MEN1 (0.39) LMNAKMT2AALDH1A1MEN1MAPT
SCHEMBL8686069 0.75 RAB9A (0.38) LMNAKMT2AALDH1A1MEN1MAPT
SCHEMBL8684409 0.74 KAT6A (0.39) LMNAALDH1A1
SCHEMBL8666843 0.74 MEN1 (0.38) KMT2AALDH1A1L3MBTL1MEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5707991-A TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE RHONE-POULENC RORER S.A. (FR) 1998-01-13 US disclosed