SCHEMBL7038013

SCHEMBL7038013

Cn1c(=O)n(Cc2ccccc2)c(=O)c2cc(C(=O)NCCc3c[nH]c4ccccc34)sc21

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
MAPT P10636 2/20 0.56
KMT2A Q03164 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
GPR18 Q14330 10/20 0.53
ALOX15 P16050 1/20 0.50
SNCA P37840 2/20 0.49
CNR2 P34972 3/20 0.49
ACHE P22303 1/20 0.49
CDK4 P11802 1/20 0.48
CCND1 P24385 1/20 0.48
CNR1 P21554 2/20 0.47

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
SCHEMBL6258474 0.86 POLB (0.52) MAPTALDH1A1SMN1; SMN2
SCHEMBL7036257 0.82 TRPA1 (0.47) MAPTALDH1A1
SCHEMBL7037571 0.82 HPGD (0.48) MAPTALDH1A1SMN1; SMN2
SCHEMBL7038057 0.82 MAPT (0.49) MAPTTDP1ALDH1A1SMN1; SMN2NPSR1
SCHEMBL6245168 0.82 TRPA1 (0.62) MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL7036764 0.82 TP53 (0.55) MAPTTDP1ALDH1A1SMN1; SMN2
SCHEMBL7037451 0.81 TRPA1 (0.54) MAPTALDH1A1SMN1; SMN2NPSR1NPC1
SCHEMBL7023804 0.81 TRPA1 (0.54) MAPTALDH1A1NPSR1RAB9ACNR2
SCHEMBL7039218 0.80 POLB (0.55) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL7032494 0.80 CLK1 (0.53) MEN1MAPTKMT2AALDH1A1NPC1

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 MEN1 3056/4885MAPT 4800/4885KMT2A 1976/4885

“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.