SCHEMBL6538650

SCHEMBL6538650

COC(=O)c1cc(-c2ccc(=O)n(C(C)C)n2)c(-c2ccccc2)nc1C(OC)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GABRA1 P14867 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA3 P34903 2/20 0.38
TP53 P04637 2/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 1/20 0.35
ALDH1A1 P00352 4/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA2 P47869 1/20 0.35
FGFR1 P11362 1/20 0.34
SRC P12931 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34

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
SCHEMBL6538393 0.92 TP53 (0.36) MAPTKMT2ATP53POLBLMNA
SCHEMBL6538457 0.87 MAPT (0.41) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6538930 0.86 POLB (0.42) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6538824 0.85 MEN1 (0.39) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6538316 0.85 TP53 (0.39) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6538327 0.84 MAPT (0.38) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6539265 0.81 MEN1 (0.40) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6538780 0.81 MEN1 (0.37) MAPTMEN1KMT2AGABRA1GABRG2
SCHEMBL6539126 0.81 ALDH1A1 (0.39) MAPTTP53POLBLMNAALDH1A1
SCHEMBL6538481 0.81 CNR1 (0.39) MAPTMEN1KMT2AGABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 US disclosed
WO-2004022540-A2 PYRIDAZINONE AND PYRIDONE DERIVATIVES AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-18 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 (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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 MAPT 629/4885MEN1 2568/4885KMT2A 3111/4885

“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.