SCHEMBL998433

SCHEMBL998433

COc1ccccc1C1c2[nH]c3ncccc3c2CCN1C(=O)Nc1cc(C)cc(C)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
TP53 P04637 5/20 0.47
SHMT2 P34897 1/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LHCGR P22888 1/20 0.43
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 3/20 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
SCHEMBL1001191 0.93 ALDH1A1 (0.49) MAPTTP53SHMT2ALDH1A1NPSR1
SCHEMBL998419 0.91 MAPT (0.50) MAPTTP53ALDH1A1KDM4ELHCGR
SCHEMBL999190 0.91 MAPT (0.50) MAPTTP53SHMT2ALDH1A1KDM4E
SCHEMBL997538 0.91 MAPT (0.46) MAPTTP53NPSR1LHCGRLMNA
SCHEMBL997584 0.88 TP53 (0.60) MAPTTP53SHMT2ALDH1A1NPSR1
SCHEMBL998055 0.88 ABCB1 (0.53) MAPTTP53LHCGRLMNAPOLB
SCHEMBL1000508 0.86 TP53 (0.53) MAPTTP53SHMT2ALDH1A1LHCGR
SCHEMBL998361 0.86 MAPT (0.62) MAPTTP53ALDH1A1LHCGRLMNA
SCHEMBL998517 0.85 TP53 (0.53) MAPTTP53SHMT2ALDH1A1KDM4E
SCHEMBL995264 0.85 POLB (0.51) MAPTTP53SHMT2ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872133-B2 Tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-18 US disclosed
US-20060154944-A1 Novel tricyclic heterocycle compound ONO PHARMACEUTICAL CO., LTD. (JP) 2006-07-13 US disclosed
EP-1637521-A1 NOVEL TRICYCLIC HETEROCYCLE COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2006-03-22 EP 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-20060154944-A1 Novel tricyclic heterocycle compound CYP11B1, CYP11B2, HCCS MAPT 4705/4885TP53 945/4885SHMT2 579/4885

“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.