SCHEMBL6285558

SCHEMBL6285558

Cc1cc(=O)c2c(=O)n(CCCC[C@@H](C)N(C)C)c(=O)n(C)c2[nH]1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
PABPC1 P11940 1/20 0.38
CYP2C9 P11712 2/20 0.35
GAA P10253 5/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 2/20 0.32
TNF P01375 1/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6285561 1.00 POLB (0.38) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6283304 0.86 POLB (0.39) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6283312 0.86 POLB (0.39) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6289499 0.84 POLB (0.38) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6289497 0.84 POLB (0.38) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6289984 0.81 GAA (0.37) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6289989 0.81 GAA (0.37) POLBPABPC1CYP2C9GAACYP1A2
SCHEMBL6284299 0.72 CHRNB2 (0.32) CYP1A2KMT2ATNFALDH1A1
SCHEMBL6286795 0.72 SMN1; SMN2 (0.39) KMT2AALDH1A1
SCHEMBL6286791 0.72 SMN1; SMN2 (0.39) KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059685-A1 Pyridopyrimidine compounds and their uses CELL THERAPEUTICS, INC. (US) 2005-03-17 US disclosed
US-6825180-B2 CYTOKINE INTRACELLULAR SIGNALING INHIBITORS; ANTIINFLAMMATORY AGENTS CELL THERAPEUTICS, INC. 2004-11-30 US disclosed
US-20040023995-A1 Pyridopyrimidine compounds and their uses CELL THERAPEUTICS, INC. 2004-02-05 US disclosed
WO-2002094824-A1 PYRIDOPYRIMIDINE COMPOUNDS AND THEIR USES CELL THERAPEUTICS, INC. (US) 2002-11-28 WO 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 (2 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-20040023995-A1 Pyridopyrimidine compounds and their uses PLPBP, MAVS, PDXK POLB 1069/4885PABPC1 983/4885CYP2C9 4462/4885
US-20050059685-A1 Pyridopyrimidine compounds and their uses PLPBP, MAVS, PDXK POLB 1069/4885PABPC1 983/4885CYP2C9 4462/4885

“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.