SCHEMBL10102164

SCHEMBL10102164

Cc1ccc(C(O)C2CCC(=O)CC2)cc1OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.36
BCHE P06276 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE4B Q07343 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
DHODH Q02127 1/20 0.33
MDM4 O15151 1/20 0.32
MDM2 Q00987 1/20 0.32

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
SCHEMBL661555 0.85 PDE4B (0.45) ACHEL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL10102167 0.79 ESR2 (0.46) ACHEBCHEL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL10102162 0.77 SYK (0.34) ACHEBCHEL3MBTL1MEN1KMT2A
SCHEMBL10101859 0.74 UGT2B7 (0.41) ACHEBCHEL3MBTL1ALDH1A1GAA
SCHEMBL10101848 0.73 ACHE (0.43) ACHEBCHESMN1; SMN2
SCHEMBL4808673 0.71 PDE4A (0.46) HPGDPDE4BPDE4APDE4CPDE4D
SCHEMBL12160695 0.70 LMNA (0.52) ACHEBCHEL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL25180344 0.70 ACHE (0.41) ACHEBCHESMN1; SMN2
SCHEMBL14042199 0.69 HIF1A (0.46) ACHEL3MBTL1KMT2APDE4BPDE4A
SCHEMBL10107050 0.68 ESR2 (0.44) ACHEL3MBTL1KMT2AALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536157-B2 Non-steroidal compounds THE UNIVERSITY OF MELBOURNE (AU) 2013-09-17 US disclosed
US-20120046255-A1 NON-STEROIDAL COMPOUNDS THE UNIVERSITY OF MELBOURNE of ROYAL PARADE PARKVILLE (AU) 2012-02-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120046255-A1 NON-STEROIDAL COMPOUNDS PTGES2, PTGES, PTGES3 ACHE 2707/4885BCHE 2145/4885L3MBTL1 4843/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.