SCHEMBL7037571

SCHEMBL7037571

Cn1c(=O)n(Cc2ccccc2)c(=O)c2cc(C(=O)NCCc3ccc(Cl)cc3Cl)sc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.48
TRPA1 O75762 2/20 0.47
PLAAT3 P53816 1/20 0.46
PLAAT5 Q96KN8 1/20 0.46
PLAAT2 Q9NWW9 1/20 0.46
PLAAT4 Q9UL19 1/20 0.46
TP53 P04637 3/20 0.45
MAPT P10636 3/20 0.44
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GFER P55789 1/20 0.43
F10 P00742 1/20 0.43
METAP2 P50579 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
RXFP1 Q9HBX9 2/20 0.42
POLB P06746 1/20 0.42
AKT3 Q9Y243 1/20 0.42
ABL1 P00519 1/20 0.42

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
SCHEMBL6727884 0.91 TRPA1 (0.54) TRPA1TP53MAPT
SCHEMBL7036764 0.89 TP53 (0.55) TRPA1TP53MAPTSMN1; SMN2ALDH1A1
SCHEMBL6258474 0.88 POLB (0.52) HPGDTRPA1TP53MAPTSMN1; SMN2
SCHEMBL7036257 0.86 TRPA1 (0.47) HPGDTRPA1TP53MAPTKDM4E
SCHEMBL7038057 0.84 MAPT (0.49) HPGDTP53MAPTSMN1; SMN2KDM4E
SCHEMBL6257817 0.83 TRPA1 (0.66) TRPA1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL7037451 0.83 TRPA1 (0.54) TRPA1TP53MAPTSMN1; SMN2ALDH1A1
SCHEMBL7023804 0.83 TRPA1 (0.54) HPGDTRPA1TP53MAPTKDM4E
SCHEMBL7038013 0.82 MEN1 (0.56) MAPTSMN1; SMN2ALDH1A1
SCHEMBL6449860 0.82 MAPT (0.56) HPGDTRPA1TP53MAPTSMN1; 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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US claimed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 HPGD 193/4885TRPA1 3888/4885PLAAT3 1022/4885

“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.