SCHEMBL6539165

SCHEMBL6539165

CC(C)n1nc(CC(=O)c2ccccc2Br)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 7/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 1/20 0.37
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
BRCA1 P38398 1/20 0.36
CASP7 P55210 1/20 0.36
TSHR P16473 2/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 2/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
GUSB P08236 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 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
SCHEMBL6133646 0.86 PTPN1 (0.39) POLBMAPTALDH1A1HSD17B10RAB9A
SCHEMBL6133925 0.81 CTNNB1 (0.41) POLBRAB9AGAANPC1LMNA
SCHEMBL7064719 0.74 POLB (0.38) POLBMAPTALDH1A1HPGDTSHR
SCHEMBL23370058 0.72 POLB (0.36) POLBMAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL6134144 0.71 MEN1 (0.43) MAPTALDH1A1KMT2AMEN1
SCHEMBL6133926 0.70 NPSR1 (0.44) POLBNPSR1ALDH1A1SMN1; SMN2TSHR
SCHEMBL6826156 0.68 POLB (0.44) POLBMAPTALDH1A1HPGDTSHR
SCHEMBL6134086 0.68 ALDH1A1 (0.41) NPSR1MAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL5951330 0.66 F2R (0.52) NPSR1MAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL22667221 0.65 BMPR1B (0.34) POLBMAPTALDH1A1SMN1; SMN2LMNA

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 POLB 2406/4885NPSR1 294/4885MAPT 629/4885

“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.