SCHEMBL6801792

SCHEMBL6801792

O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.56
P2RX1 P51575 2/20 0.56
APOB P04114 9/20 0.54
MTTP P55157 8/20 0.54
LMNA P02545 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HTT P42858 2/20 0.54
MAPT P10636 6/20 0.53
ALDH1A1 P00352 1/20 0.53
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TRPV1 Q8NER1 1/20 0.51
MCL1 Q07820 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL6794883 0.89 P2RX1 (0.56) P2RX1APOBMTTPLMNAMAPT
SCHEMBL6638787 0.88 LMNA (0.55) TP53P2RX1LMNAMEN1KMT2A
SCHEMBL6488558 0.87 LMNA (0.50) TP53P2RX1APOBMTTPLMNA
SCHEMBL6789872 0.87 TP53 (0.53) TP53P2RX1LMNAMEN1KMT2A
SCHEMBL6805325 0.83 KCNMA1 (0.51) P2RX1APOBMTTPLMNAMEN1
SCHEMBL6805317 0.83 KCNMA1 (0.51) P2RX1APOBMTTPLMNAMEN1
SCHEMBL6794433 0.83 ABCG2 (0.70) P2RX1APOBMTTPMEN1KMT2A
SCHEMBL1455315 0.80 MAPT (0.77) TP53LMNAMEN1KMT2AHTT
SCHEMBL6804166 0.79 SMO (0.61) P2RX1APOBMTTPLMNAHTT
SCHEMBL14031525 0.79 KCNMA1 (0.66) P2RX1APOBMTTPLMNAHTT

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 US disclosed
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 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 (2 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-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 TP53 4865/4885P2RX1 3450/4885APOB 1/4885
US-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 TP53 4791/4885P2RX1 4122/4885APOB 1/4885

“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.