SCHEMBL14020128

SCHEMBL14020128

CCN1C(=O)C(=C2SCCS2)C(=O)N(CC)C1=S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.46
KMT2A Q03164 9/20 0.46
RXFP1 Q9HBX9 2/20 0.46
ALDH1A1 P00352 14/20 0.41
MAPT P10636 9/20 0.41
TNFRSF1A P19438 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 3/20 0.41
POLB P06746 3/20 0.41
NPC1 O15118 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
TNNI3 P19429 1/20 0.36
CYP2C19 P33261 1/20 0.36
TNNT2 P45379 1/20 0.36
TNNC1 P63316 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL12609622 0.78 KMT2A (0.50) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL12609668 0.78 MEN1 (0.50) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL12609655 0.74 MEN1 (0.43) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL12609730 0.73 MEN1 (0.49) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL14414122 0.73 MEN1 (0.46) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL21104341 0.72 MEN1 (0.47) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL9857493 0.71 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL12609626 0.71 MEN1 (0.44) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL22174138 0.71 MEN1 (0.48) MEN1KMT2ARXFP1ALDH1A1MAPT
SCHEMBL16708750 0.71 MEN1 (0.35) MEN1KMT2ARXFP1ALDH1A1MAPT

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-1688466-B1 Ink composition, ink jet recording method, printed material, method of producing planographic printing plate, and planographic printing plate FUJIFILM CORP (JP) 2008-11-26 EP disclosed