SCHEMBL4155709

SCHEMBL4155709

CC(=O)Nc1ccc2c(Cl)c3ccc([N+](=O)[O-])cc3nc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.54
MAPT P10636 6/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
MEN1 O00255 6/20 0.51
GAA P10253 2/20 0.51
PKM P14618 1/20 0.51
KDM4E B2RXH2 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
GLA P06280 1/20 0.50
TNNI3 P19429 1/20 0.50
TNNT2 P45379 1/20 0.50
TNNC1 P63316 1/20 0.50
RUNX1 Q01196 1/20 0.50
CBFB Q13951 1/20 0.50
DYRK1A Q13627 1/20 0.48
PABPC1 P11940 1/20 0.48
ABCG2 Q9UNQ0 2/20 0.47
ALDH1A1 P00352 3/20 0.47
THRB P10828 1/20 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
SCHEMBL4164355 0.88 SMN1; SMN2 (0.53) KMT2AMAPTSMN1; SMN2MEN1GAA
SCHEMBL13697265 0.88 ABCG2 (0.55) KMT2AMAPTSMN1; SMN2MEN1GAA
SCHEMBL17154385 0.82 KMT2A (0.60) KMT2AMAPTSMN1; SMN2MEN1GAA
SCHEMBL17154381 0.82 ACHE (0.52) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL17154375 0.80 KMT2A (0.66) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL13697360 0.78 ABCG2 (0.55) KMT2AMAPTSMN1; SMN2MEN1GAA
SCHEMBL17154359 0.77 KMT2A (0.54) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL4167466 0.76 MAOA (0.56) KMT2AMAPTSMN1; SMN2MEN1GAA
SCHEMBL17154382 0.73 ALDH1A1 (0.47) KMT2AMAPTSMN1; SMN2MEN1KDM4E
SCHEMBL642700 0.73 KMT2A (0.81) KMT2AMAPTSMN1; SMN2MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9127164-B2 Fluorescent dyes and uses thereof ALMAC SCIENCES (SCOTLAND) LIMITED (GB) 2015-09-08 US disclosed
EP-1940965-B1 NOVEL FLUORESCENT DYES AND USES THEREOF ALMAC SCIENCES SCOTLAND LTD (GB) 2014-03-26 EP disclosed
US-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ITI SCOTLAND LIMITED (GB) 2009-09-10 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-20090226940-A1 NOVEL FLUORESCENT DYES AND USES THEREOF ACR, ANXA5, GLB1 KMT2A 4502/4885MAPT 2114/4885SMN1; SMN2 3974/4885

“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.