SCHEMBL5223087

SCHEMBL5223087

O=C(Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.72
MEN1 O00255 3/20 0.70
KMT2A Q03164 3/20 0.70
MAPK1 P28482 1/20 0.70
SMN1; SMN2 Q16637 3/20 0.69
GAA P10253 3/20 0.69
HTT P42858 2/20 0.69
NCOA1 Q15788 1/20 0.69
NCOA3 Q9Y6Q9 1/20 0.69
P2RX1 P51575 1/20 0.63
ALDH1A1 P00352 5/20 0.62
LMNA P02545 3/20 0.62
RAB9A P51151 3/20 0.61
MAPT P10636 2/20 0.61
NPC1 O15118 1/20 0.61
GLA P06280 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
POLB P06746 1/20 0.59

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
SCHEMBL18145976 0.88 MDM2 (0.65) MDM2MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL995085 0.87 GAA (0.77) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL7160767 0.87 P2RX1 (0.65) MDM2MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL94829 0.86 GAA (0.71) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL4958300 0.86 GAA (0.71) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL27657640 0.86 GAA (0.71) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL4958310 0.86 GAA (0.71) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL18146128 0.86 MDM2 (0.62) MDM2MEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL6814805 0.85 GAA (0.69) MEN1KMT2ASMN1; SMN2GAAHTT
SCHEMBL5226448 0.85 MAPT (0.78) MEN1KMT2ASMN1; SMN2GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103130696-B Anthranilamide compound as well as preparation method and application thereof UNIV SHANDONG 2014-06-11 CN claimed
CN-103130696-B Anthranilamide compound as well as preparation method and application thereof UNIV SHANDONG 2014-06-11 CN disclosed
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
US-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 US disclosed
US-6313122-B1 AS INHIBITORS OF FACTOR XA AND ARE USED AS ANTICOAGULANTS IN MAMMALS ELI LILLY AND COMPANY 2001-11-06 US disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 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-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 MDM2 4850/4885MEN1 1119/4885KMT2A 2083/4885

“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.