SCHEMBL13624078

SCHEMBL13624078

COCCOc1ccc(C)cc1C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
L3MBTL1 Q9Y468 7/20 0.47
MAPT P10636 6/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
USP2 O75604 2/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX12 P18054 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
KDM4E B2RXH2 6/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
TP53 P04637 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
SCHEMBL12180490 0.85 ALDH1A1 (0.50) MAPK1HTTMEN1KMT2AL3MBTL1
SCHEMBL30087029 0.84 USP2 (0.44) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL1042008 0.84 USP2 (0.44) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL16504740 0.84 ALDH1A1 (0.53) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL1535626 0.83 LMNA (0.51) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL15349624 0.82 USP2 (0.47) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL31705359 0.81 MEN1 (0.46) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL9978253 0.81 LMNA (0.47) MAPK1LMNAHTTKMT2AL3MBTL1
SCHEMBL9885324 0.80 KMT2A (0.47) MAPK1LMNAHTTMEN1KMT2A
SCHEMBL31705365 0.80 L3MBTL1 (0.48) MAPK1LMNAHTTMEN1KMT2A

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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF MAPK1 780/4885LMNA 4790/4885HTT 1913/4885

“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.