SCHEMBL8329109

SCHEMBL8329109

CCOC(=O)c1ccc(NC(=O)OC(C)(C)C)c(CC)c1C(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
ELANE P08246 1/20 0.39
PRTN3 P24158 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TP53 P04637 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL28493853 0.77 KDM4E (0.60) HTTTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL15440468 0.77 LMNA (0.49) HTTTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL31478177 0.76 MEN1 (0.41) TSHRSMN1; SMN2MEN1KMT2ACRHBP
SCHEMBL31478121 0.76 MEN1 (0.41) TSHRSMN1; SMN2MEN1KMT2ACRHBP
SCHEMBL6181078 0.75 RXFP1 (0.38) SMN1; SMN2ELANEPOLBLMNACYP2C9
SCHEMBL4050633 0.75 CNR2 (0.38) SMN1; SMN2MEN1KMT2AALDH1A1KDM4E
SCHEMBL26745357 0.74 CYP1A2 (0.54) TSHRSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL16183923 0.74 CYP1A2 (0.54) TSHRSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL28465214 0.72 TSHR (0.51) HTTCASP3SENP8SENP7SENP6
SCHEMBL2703465 0.72 ALDH1A1 (0.54) HTTGAAKMT2AELANEALDH1A1

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-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed