SCHEMBL998141

SCHEMBL998141

COc1cccc(C2c3[nH]c4ccccc4c3C3(CC3)CN2C(=O)Nc2cc(C)cc(C)c2)c1OC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 11/20 0.42
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PAX8 Q06710 2/20 0.39
TP53 P04637 4/20 0.39
TSHR P16473 3/20 0.39
ATM Q13315 1/20 0.39
THRB P10828 1/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL998300 0.94 MAPT (0.43) ALDH1A1SMN1; SMN2L3MBTL1MAPTLMNA
SCHEMBL997740 0.90 PAX8 (0.41) MAPTLMNANPSR1PAX8TP53
SCHEMBL999200 0.89 PAX8 (0.45) MAPTLMNANPSR1PAX8TP53
SCHEMBL999048 0.88 PAX8 (0.45) MAPTLMNAPAX8TP53THRB
SCHEMBL998636 0.87 ABCB1 (0.49) ALDH1A1MAPTLMNAHTTPAX8
SCHEMBL998536 0.86 TP53 (0.53) ALDH1A1MAPTLMNANPSR1KDM4E
SCHEMBL997745 0.85 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2L3MBTL1MAPTLMNA
SCHEMBL998781 0.84 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2L3MBTL1MAPTLMNA
SCHEMBL998229 0.84 ABCG2 (0.50) MAPTNPSR1KDM4EPAX8TP53
SCHEMBL998866 0.84 TP53 (0.47) ALDH1A1MAPTLMNANPSR1KDM4E

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 ALDH1A1 1422/4885SMN1; SMN2 4273/4885L3MBTL1 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.