SCHEMBL997758

SCHEMBL997758

COC(=O)N1CC2(CC2)c2c([nH]c3ccccc23)C1c1cc(F)cc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 11/20 0.41
ABCB1 P08183 10/20 0.41
LMNA P02545 2/20 0.41
KIF11 P52732 2/20 0.41
TP53 P04637 2/20 0.39
STAT3 P40763 1/20 0.37

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
SCHEMBL999146 0.94 KIF11 (0.43) ABCG2ABCB1LMNAKIF11TP53
SCHEMBL1001235 0.91 ABCB1 (0.48) ABCG2ABCB1LMNATP53
SCHEMBL999901 0.89 ABCG2 (0.52) ABCG2ABCB1LMNAKIF11TP53
SCHEMBL997890 0.89 KIF11 (0.49) ABCG2ABCB1LMNAKIF11TP53
SCHEMBL997746 0.88 ABCG2 (0.49) ABCG2ABCB1LMNAKIF11TP53
SCHEMBL998139 0.87 MAPT (0.42) ABCG2ABCB1LMNATP53STAT3
SCHEMBL998525 0.86 ABCG2 (0.56) ABCG2ABCB1LMNAKIF11TP53
SCHEMBL996744 0.86 ALDH1A1 (0.46) ABCG2ABCB1LMNATP53STAT3
SCHEMBL997599 0.85 ABCG2 (0.55) ABCG2ABCB1LMNATP53
SCHEMBL999983 0.85 ABCG2 (0.52) ABCG2ABCB1LMNATP53

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 ABCG2 309/4885ABCB1 307/4885LMNA 528/4885

“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.