SCHEMBL18384605

SCHEMBL18384605

COc1c2ccncc2c(OC)c2sc(C=O)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 4/20 0.42
▸ MAOA P21397 3/20 0.38
▸ ICAM1 P05362 1/20 0.34
▸ SELE P16581 1/20 0.34
▸ CHUK O15111 2/20 0.33
▸ CYP2E1 P05181 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2B6 P20813 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KDR P35968 2/20 0.32
▸ FLT3 P36888 2/20 0.32
▸ GSK3B P49841 2/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ TAF1 P21675 2/20 0.32
▸ TGFBR1 P36897 2/20 0.32
▸ ACVR1 Q04771 2/20 0.32
▸ CREBBP Q92793 2/20 0.32
▸ CECR2 Q9BXF3 2/20 0.32
▸ BRD9 Q9H8M2 2/20 0.32

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
SCHEMBL18384711 1.00 CYP2A6 (0.42) CYP2A6MAOAICAM1SELECHUK
SCHEMBL18419268 0.84 MAOA (0.35) MAOACHUK
SCHEMBL18384590 0.79 MAOA (0.41) MAOACHUKCYP3A4CYP2C9CYP2C19
SCHEMBL18384713 0.78 CCNC (0.43) CYP3A4CYP2D6ACHEMAOB
SCHEMBL18384609 0.78 MAOA (0.32) MAOA
SCHEMBL18419261 0.78 MAOA (0.32) MAOA
SCHEMBL18384535 0.77 KDM4E (0.39) MAOAICAM1SELEGSK3BKDM4E
SCHEMBL18384591 0.77 KDM4E (0.39) MAOAICAM1SELEGSK3BKDM4E
SCHEMBL18384600 0.77 CCNC (0.39) CYP2A6MAOAICAM1SELECHUK
SCHEMBL18384537 0.77 CCNC (0.39) CYP2A6MAOAICAM1SELECHUK

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 5 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-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
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 CYP2A6 77/4885MAOA 599/4885ICAM1 4380/4885
US-20170015677-A1 NEW TRICYCLIC QUINONE DERIVATIVE NQO1, SQOR, SULT1E1 CYP2A6 77/4885MAOA 599/4885ICAM1 4380/4885
US-10934309-B2 Tricyclic quinone derivative NQO1, NQO2, SQOR CYP2A6 84/4885MAOA 540/4885ICAM1 4405/4885

“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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