SCHEMBL13639102

SCHEMBL13639102

CCOCCCCCOc1cccc(C(C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
HTT P42858 1/20 0.55
SOD1 P00441 1/20 0.49
TSHR P16473 2/20 0.46
CYP2D6 P10635 3/20 0.44
CACNA1B Q00975 3/20 0.44
FFAR1 O14842 2/20 0.43
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
HTR1A P08908 1/20 0.41
HTR7 P34969 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
GGPS1 O95749 1/20 0.40

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
SCHEMBL13639099 0.98 L3MBTL1 (0.56) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL20267505 0.85 L3MBTL1 (0.58) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL13821977 0.84 L3MBTL1 (0.57) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL12251342 0.83 L3MBTL1 (0.60) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL10651034 0.83 LMNA (0.56) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL10211503 0.82 L3MBTL1 (0.57) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL29979999 0.81 CYP3A4 (0.55) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL5619009 0.81 CYP3A4 (0.55) L3MBTL1LMNAPOLBHTTSOD1
SCHEMBL13639039 0.80 PPARA (0.40) L3MBTL1PPARG
SCHEMBL13639038 0.80 PPARA (0.40) L3MBTL1PPARG

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-8304385-B2 Macrocyclic tetrazolyl hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-11-06 US disclosed
US-20090142299-A1 MACROCYCLIC TETRAZOLYL HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-06-04 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-20090142299-A1 MACROCYCLIC TETRAZOLYL HEPATITIS C SERINE PROTEASE INHIBITORS TMPRSS4, PRSS1, SPINT2 L3MBTL1 3177/4885LMNA 3383/4885POLB 4230/4885

“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.