SCHEMBL2633830

SCHEMBL2633830

COCCN1C(=O)CSC1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.58
▸ MAPT P10636 3/20 0.56
▸ GAA P10253 3/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ GSK3A P49840 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ LMNA P02545 1/20 0.38

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
SCHEMBL7878513 0.89 MAPT (0.53) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL12288367 0.80 MAPT (0.50) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL6073396 0.78 MAPT (0.61) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL11820448 0.78 RECQL (0.48) ALDH1A1MAPTGAAGSK3AGSK3B
SCHEMBL11820453 0.78 RECQL (0.48) ALDH1A1MAPTGAAGSK3AGSK3B
SCHEMBL24796120 0.75 MAPT (0.54) ALDH1A1MAPTGAASMN1; SMN2POLB
SCHEMBL9068830 0.74 MAPT (0.58) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL11173506 0.74 MAPT (0.56) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL2360918 0.74 MAPT (0.56) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL1693423 0.74 MAPT (0.56) ALDH1A1MAPTGAASMN1; SMN2HSD17B10

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-2011149841-A1 SUBSTITUTED THIAZOLIDINEDIONE INDAZOLES, INDOLES AND BENZOTRIAZOLES AS ESTROGEN-RELATED RECEPTOR-α MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-12-01 — — WO disclosed
Send feedback