SCHEMBL30088674

SCHEMBL30088674

CCOc1ccc(NC(=O)N2CCCC2)cc1S(=O)(=O)Cl

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
MAPT P10636 6/20 0.50
KMT2A Q03164 3/20 0.50
HTT P42858 3/20 0.50
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
USP2 O75604 1/20 0.48
MAPK1 P28482 1/20 0.47
TSHR P16473 1/20 0.46
ABL1 P00519 1/20 0.46
POLB P06746 1/20 0.46
RIN1 Q13671 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 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
SCHEMBL256091 0.82 L3MBTL1 (0.61) L3MBTL1MAPTKMT2AHTTMEN1
SCHEMBL2436014 0.81 RORC (0.66) MAPTKMT2AMEN1ALDH1A1USP2
SCHEMBL256088 0.81 L3MBTL1 (0.60) L3MBTL1MAPTKMT2AHTTMEN1
SCHEMBL16638506 0.80 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AHTTMEN1
SCHEMBL16638507 0.79 L3MBTL1 (0.57) L3MBTL1MAPTKMT2AHTTMEN1
SCHEMBL257067 0.71 SMN1; SMN2 (0.64) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL9967740 0.70 SMN1; SMN2 (0.61) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL3687471 0.70 KDM4E (0.50) HTTALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL22637078 0.70 SMN1; SMN2 (0.51) L3MBTL1MAPTKMT2ANPC1RAB9A
SCHEMBL29430715 0.70 SMN1; SMN2 (0.51) L3MBTL1MAPTKMT2ANPC1RAB9A

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-11512294-B2 Cyclic GMP-chelating peptides for subcellular targeting SORBAOONE UNIVERSITE (FR) 2022-11-29 US disclosed