SCHEMBL6173963

SCHEMBL6173963

CCC(C)(Cc1ccc(S(C)(=O)=O)cc1)NCCCCN1CCN(S(C)(=O)=O)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.39
SMN1; SMN2 Q16637 8/20 0.39
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
PKM P14618 6/20 0.36
ALDH1A1 P00352 5/20 0.36
GAA P10253 2/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL6985419 0.88 KMT2A (0.41) KMT2AMEN1ALDH1A1POLBTDP1
SCHEMBL6984916 0.88 KMT2A (0.41) KMT2AMEN1ALDH1A1POLBTDP1
SCHEMBL6172884 0.81 LMNA (0.30) LMNASMN1; SMN2
SCHEMBL6173400 0.81 ACHE (0.31) LMNASMN1; SMN2
SCHEMBL6986506 0.80 SMN1; SMN2 (0.37) SMN1; SMN2MAPTKMT2AALDH1A1HTT
SCHEMBL6172320 0.79 SMN1; SMN2 (0.33) LMNASMN1; SMN2MAPTKMT2AMEN1
SCHEMBL6982440 0.79 PDK1 (0.41) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6173064 0.78 CCR2 (0.33) KMT2AALDH1A1POLBTDP1
SCHEMBL7088516 0.78 GPR119 (0.45)
SCHEMBL6174487 0.78 GPR119 (0.30) LMNASMN1; SMN2

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
EP-1289965-B1 SUBSTITUTED 1-AMINOALKYL-LACTAMS AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2005-10-26 EP disclosed