SCHEMBL18384591

SCHEMBL18384591

COc1c2ccncc2c(OC)c2sc(C(=O)O)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ GLA P06280 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ NCOA1 Q15788 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RCE1 Q9Y256 1/20 0.39
▸ NCOA3 Q9Y6Q9 1/20 0.39
▸ TBXAS1 P24557 1/20 0.38
▸ MAP3K8 P41279 3/20 0.38
▸ MAOA P21397 2/20 0.38
▸ CCNC P24863 2/20 0.38
▸ CDK8 P49336 2/20 0.38
▸ CSNK2A1 P68400 3/20 0.36
▸ PLK4 O00444 1/20 0.36
▸ AURKA O14965 1/20 0.36

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
SCHEMBL18384535 1.00 KDM4E (0.39) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384596 0.91 KDM4E (0.43) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384551 0.91 KDM4E (0.43) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384537 0.90 CCNC (0.39) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384600 0.90 CCNC (0.39) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384584 0.88 MAOA (0.37) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384580 0.88 ICAM1 (0.46) CCNCCDK8AURKADAPK3CDK1
SCHEMBL18384554 0.86 ICAM1 (0.42) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384545 0.84 CCNC (0.43) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL18384532 0.80 HPGD (0.48) KDM4EALDH1A1GLAGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10934309-B2 Tricyclic quinone derivative SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. (US) 2021-03-02 — — US disclosed
US-10934309-B2 Tricyclic quinone derivative SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. (US) 2021-03-02 — — US disclosed
US-20190241583-A1 NEW TRICYCLIC QUINONE DERIVATIVE SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. 2019-08-08 — — US disclosed
US-20190241583-A1 NEW TRICYCLIC QUINONE DERIVATIVE SUMITOMO DAINIPPON PHARMA ONCOLOGY, INC. 2019-08-08 — — US disclosed
EP-3127907-A1 NEW TRICYCLIC QUINONE DERIVATIVE Boston Biomedical, Inc. (US) 2017-02-08 — — EP disclosed
EP-3127907-A1 NEW TRICYCLIC QUINONE DERIVATIVE Boston Biomedical, Inc. (US) 2017-02-08 — — EP disclosed
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE BOSTON BIOMEDICAL, INC. (US) 2017-01-19 — — US disclosed
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE BOSTON BIOMEDICAL, INC. (US) 2017-01-19 — — US disclosed
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE BOSTON BIOMEDICAL, INC. (US) 2017-01-19 — — 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 (3 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-20190241583-A1 NEW TRICYCLIC QUINONE DERIVATIVE NQO1, SQOR, SULT1E1 KDM4E 2727/4885ALDH1A1 143/4885GLA 2612/4885
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE NQO1, SQOR, SULT1E1 KDM4E 2727/4885ALDH1A1 143/4885GLA 2612/4885
US-10934309-B2 Tricyclic quinone derivative NQO1, NQO2, SQOR KDM4E 2785/4885ALDH1A1 154/4885GLA 2459/4885

“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.

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