SCHEMBL6808697

SCHEMBL6808697

O=C(Nc1ccc2c(c1)CCN2)c1ccccc1-c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
RXFP1 Q9HBX9 2/20 0.49
HTT P42858 1/20 0.49
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HSPA9 P38646 2/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ATM Q13315 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 2/20 0.43
HDAC6 Q9UBN7 1/20 0.42
MITF O75030 1/20 0.42
CFTR P13569 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41

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
SCHEMBL6664567 0.89 KMT2A (0.47) MAPTSMN1; SMN2ALDH1A1RXFP1HTT
SCHEMBL6662843 0.85 SLC2A1 (0.49) ALDH1A1HTTMEN1KMT2AATM
SCHEMBL6804465 0.85 L3MBTL1 (0.52) ALDH1A1HTTMEN1KMT2AATM
Hydrochloric Acid SCHEMBL6803617 0.84 L3MBTL1 (0.51) ALDH1A1HTTMEN1KMT2AATM
SCHEMBL6803227 0.84 APOB (0.48) MEN1KMT2AATMTP53CFTR
SCHEMBL6803364 0.82 GAA (0.61) MAPTSMN1; SMN2ALDH1A1HTTNPC1
SCHEMBL6645543 0.82 MTTP (0.61) MAPTSMN1; SMN2ALDH1A1TP53APOB
Hydrochloric Acid SCHEMBL6803931 0.82 MTTP (0.60) MAPTSMN1; SMN2ALDH1A1TP53APOB
SCHEMBL31155757 0.77 CHRNB2 (0.69) MAPTSMN1; SMN2ALDH1A1RXFP1HTT
SCHEMBL6801574 0.77 APOB (0.49) RXFP1APOBMTTP

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-20040157866-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-12 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-20040157866-A1 Amide compounds APOB, NR1H2, NR1H3 MAPT 4047/4885SMN1; SMN2 1854/4885ALDH1A1 2901/4885

“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.