SCHEMBL6426299

SCHEMBL6426299

CCC(C)NC1=NC(=O)C(CC(=O)N2CCCc3ccccc32)S1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 3/20 0.46
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NOTUM Q6P988 1/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL6503442 0.94 GRM7 (0.44) GRM7LMNAMAPTPOLBKMT2A
SCHEMBL6428624 0.87 GRM7 (0.45) GRM7LMNAMAPTKMT2ANPSR1
SCHEMBL6507627 0.86 GRM7 (0.46) GRM7MAPTPOLBKMT2ANPSR1
SCHEMBL6428159 0.86 GRM7 (0.46) GRM7MAPTPOLBKMT2ANPSR1
SCHEMBL6428309 0.83 GRM7 (0.46) GRM7MAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL6427597 0.81 ALDH1A1 (0.47) GRM7LMNAMAPTPOLBKMT2A
SCHEMBL6508360 0.81 ALDH1A1 (0.47) GRM7LMNAMAPTKMT2ANPSR1
SCHEMBL6502545 0.81 TSHR (0.53) GRM7MAPTPOLBKMT2ANPSR1
SCHEMBL6506436 0.81 TSHR (0.53) GRM7MAPTPOLBKMT2ANPSR1
SCHEMBL6500660 0.81 TSHR (0.53) GRM7MAPTPOLBKMT2ANPSR1

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
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed