SCHEMBL6791689

SCHEMBL6791689

N=C(N)c1ccc(N)cc1C(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.51
MAPT P10636 2/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 1/20 0.49
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
USP2 O75604 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
HSD17B10 Q99714 1/20 0.47
POLB P06746 1/20 0.46
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
F2 P00734 2/20 0.44
PRSS1 P07477 2/20 0.44
PRSS2 P07478 2/20 0.44
PRSS3 P35030 2/20 0.44
PLG P00747 1/20 0.44
F10 P00742 1/20 0.44

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
SCHEMBL6819339 0.86 PBRM1 (0.55) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL11147848 0.84 KDM4E (0.68) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL17008169 0.82 AKR1C3 (0.63) MAPTGAAKMT2AMEN1USP2
5-Amino-2-Benzoylbenzoic Acid SCHEMBL8999371 0.81 AKR1C3 (0.62) PBRM1MAPTGAAKDM4EKMT2A
5-Amino-2-Benzoylbenzoic Acid SCHEMBL31333092 0.81 AKR1C3 (0.62) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL5312884 0.80 MAPT (0.68) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL4351040 0.79 CYP2C9 (0.65) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL29530480 0.79 MAPT (0.66) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL30341893 0.79 CYP2C9 (0.65) PBRM1MAPTGAAKDM4EKMT2A
SCHEMBL3179244 0.79 MAPT (0.66) PBRM1MAPTGAAKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040082585-A1 Prodrugs of substituted polycyclic compounds useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2004-04-29 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-20040082585-A1 Prodrugs of substituted polycyclic compounds useful for selective inhibition of the coagulation cascade TFPI, F2, PLG PBRM1 2306/4885MAPT 4848/4885GAA 1146/4885

“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.