SCHEMBL6539043

SCHEMBL6539043

CC(=O)c1cnc(-c2ccccc2)c(-c2ccc(=O)n(C(C)C)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.49
POLB P06746 2/20 0.39
ABL1 P00519 3/20 0.39
KDR P35968 3/20 0.39
PIK3CD O00329 2/20 0.39
EGFR P00533 2/20 0.39
HCK P08631 2/20 0.39
SRC P12931 2/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CB P42338 2/20 0.39
MTOR P42345 2/20 0.39
PIK3CG P48736 2/20 0.39
EPHB4 P54760 2/20 0.39
PRKDC P78527 2/20 0.39
PI4KB Q9UBF8 2/20 0.39
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6539037 0.92 NTRK1 (0.43) TP53POLBMAPTNTRK1NTRK3
SCHEMBL6538373 0.90 AKT1 (0.47) TP53POLBALDH1A1HPGDMAPT
SCHEMBL6539298 0.89 BAZ2B (0.49) TP53POLBALDH1A1NTRK1FYN
SCHEMBL6538809 0.88 MEN1 (0.44) TP53POLBKDRSRCALDH1A1
SCHEMBL6538770 0.86 TP53 (0.39) TP53POLBABL1KDRPIK3CD
SCHEMBL6539229 0.85 ADORA2A (0.44) NPC1ALDH1A1HPGDRAB9A
SCHEMBL6539029 0.85 TP53 (0.46) TP53POLBNPC1ALDH1A1HPGD
SCHEMBL6538462 0.84 HPGDS (0.52) EGFRALDH1A1SMN1; SMN2
SCHEMBL6539018 0.84 FYN (0.47) TP53NTRK1FYN
SCHEMBL6538929 0.84 TGFBR1 (0.37) TP53POLBNPC1RAB9ASMN1; SMN2

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 TP53 3830/4885POLB 2406/4885ABL1 3080/4885

“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.