SCHEMBL996707

SCHEMBL996707

COC(=O)N1CCc2c([nH]c3ncccc23)C1c1ccccc1OC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ABCB1 P08183 4/20 0.43
ABCG2 Q9UNQ0 4/20 0.43
LMNA P02545 2/20 0.43
STAT3 P40763 2/20 0.42
HHAT Q5VTY9 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL998102 0.92 ALDH1A1 (0.55) MAPTALDH1A1L3MBTL1SMN1; SMN2NPSR1
SCHEMBL997278 0.89 MAPT (0.44) MAPTALDH1A1L3MBTL1SMN1; SMN2NPSR1
SCHEMBL998490 0.89 STAT3 (0.47) MAPTALDH1A1KDM4EABCB1ABCG2
SCHEMBL996851 0.89 STAT3 (0.49) MAPTALDH1A1L3MBTL1SMN1; SMN2KDM4E
SCHEMBL999692 0.88 ABCB1 (0.54) MAPTALDH1A1KDM4ENPSR1ABCB1
SCHEMBL998433 0.85 MAPT (0.49) MAPTALDH1A1L3MBTL1SMN1; SMN2KDM4E
SCHEMBL997415 0.85 ABCG2 (0.59) MAPTABCB1ABCG2LMNATP53
SCHEMBL997683 0.85 MAPT (0.46) MAPTALDH1A1L3MBTL1SMN1; SMN2KDM4E
SCHEMBL998171 0.84 ALDH1A1 (0.55) MAPTALDH1A1L3MBTL1SMN1; SMN2NPSR1
SCHEMBL1001208 0.84 STAT3 (0.49) MAPTALDH1A1KDM4ENPSR1ABCB1

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 4705/4885ALDH1A1 1422/4885L3MBTL1 830/4885

“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.