SCHEMBL25857017

SCHEMBL25857017

CCCCc1ccc(-c2nnc(-c3ccc4[nH]cnc4c3)o2)cc1C

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 20/20 0.48

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
SCHEMBL25857018 0.85 QPCT (0.42) QPCT
SCHEMBL2394836 0.76 QPCT (0.59) QPCT
SCHEMBL1705900 0.74 QPCT (0.84) QPCT
SCHEMBL1706309 0.73 QPCT (0.80) QPCT
SCHEMBL1706433 0.72 QPCT (0.81) QPCT
SCHEMBL28872959 0.72 POLA1 (0.45) QPCT
SCHEMBL1706431 0.71 QPCT (0.50) QPCT
SCHEMBL25857014 0.70 SPHK2 (0.39)
SCHEMBL2395925 0.70 QPCT (0.57) QPCT
SCHEMBL2396023 0.69 QPCT (0.84) QPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 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-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME S1PR1, S1PR2, S1PR3 QPCT 2503/4885

“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.