SCHEMBL17669149

SCHEMBL17669149

CCCCCCCCCCCCCCCc1cccc(OC(C)C)c1C(=O)Nc1ccncc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.48
PPARA Q07869 3/20 0.48
LMNA P02545 5/20 0.47
ALDH1A1 P00352 2/20 0.47
PPARG P37231 2/20 0.46
STAT3 P40763 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RAB9A P51151 1/20 0.43
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
KAT8 Q9H7Z6 2/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
JAK2 O60674 3/20 0.42
JAK1 P23458 2/20 0.42

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
SCHEMBL17669150 0.88 RXFP1 (0.52) HTTPPARALMNAALDH1A1PPARG
SCHEMBL2944712 0.80 PPARA (0.73) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL2945954 0.79 PPARA (0.56) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL489605 0.78 PPARA (0.55) PPARAPPARGBIDMCL1BCL2L1
SCHEMBL2950017 0.78 TRPV1 (0.47) HTTLMNAALDH1A1RAB9A
SCHEMBL2942158 0.76 AR (0.43)
SCHEMBL2950034 0.75 AR (0.52) HTTLMNAALDH1A1SMN1; SMN2CYP3A4
SCHEMBL13533513 0.75 PPARA (0.68) PPARALMNAALDH1A1PPARGSMN1; SMN2
SCHEMBL13533521 0.72 PPARA (0.58) HTTPPARALMNAALDH1A1PPARG
SCHEMBL489762 0.69 PPARA (0.46) PPARAPPARGBIDMCL1BCL2L1

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-20160101076-A1 Use of Sumoylation Inhibitors for Treating Cancer WEIGEL RONALD J (US) 2016-04-14 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-20160101076-A1 Use of Sumoylation Inhibitors for Treating Cancer SUMO2, SUMO1, UBA2 HTT 4360/4885PPARA 540/4885LMNA 3414/4885

“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.