SCHEMBL7808047

SCHEMBL7808047

O=C1c2ccccc2C(=O)c2sc(-c3ccccc3)nc21

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 0.79
TDO2 P48775 5/20 0.79
USP1 O94782 1/20 0.45
USP19 O94966 1/20 0.45
WDR48 Q8TAF3 1/20 0.45
PTGS2 P35354 2/20 0.45
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43

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
SCHEMBL7816954 0.89 IDO1 (1.00) IDO1TDO2PTGS2KDM4EALDH1A1
SCHEMBL22732884 0.88 IDO1 (0.63) IDO1TDO2PTGS2KDM4EPOLB
SCHEMBL7805767 0.87 IDO1 (0.71) IDO1TDO2USP1USP19PTGS2
SCHEMBL7805662 0.85 IDO1 (0.60) IDO1TDO2PTGS2PTGDR2MEN1
SCHEMBL7805861 0.85 IDO1 (0.60) IDO1TDO2PTGS2PTGDR2MEN1
SCHEMBL7805807 0.85 IDO1 (0.60) IDO1TDO2PTGS2KDM4EPTGDR2
SCHEMBL7808005 0.85 IDO1 (0.60) IDO1TDO2PTGS2KDM4EPTGDR2
SCHEMBL7812685 0.85 IDO1 (0.72) IDO1TDO2USP1PTGS2KDM4E
SCHEMBL8595445 0.85 IDO1 (0.82) IDO1TDO2MEN1KMT2A
SCHEMBL7805716 0.84 IDO1 (0.62) IDO1TDO2PTGS2

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-10450281-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-10-22 US disclosed
US-9725425-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-08 US disclosed
US-9725425-B1 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-08-08 US disclosed
EP-0876356-B1 USE OF TRICYCLIC 1,4-DIHYDRO-1,4-DIOXO-1H-NAPHTHALENE DERIVATIVES, RESULTING NOVEL COMPOUNDS AND THERAPEUTICAL USE THEREOF INNOTHERA SA LAB (FR) 2001-10-31 EP disclosed
US-6262095-B1 TREATMENT OF ILLNESS ASSOCIATED WITH AN ALTERATION IN VENOUS FUNCTION AND/OR INFLAMMATORY EDEMA LABORATOIRE INNOTHERA (FR) 2001-07-17 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 (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-10450281-B1 Compounds and methods for treating cancer USP8, USP2, NEDD8 IDO1 2561/4885TDO2 2554/4885USP1 7/4885

“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.