SCHEMBL6833605

SCHEMBL6833605

Cc1cc[n+](CCCCCC(=O)O)c2c(S(=O)(=O)O)cccc12

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
APEX1 P27695 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
FABP4 P15090 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TERT O14746 1/20 0.35
TBXA2R P21731 1/20 0.35
RECQL P46063 1/20 0.35
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL7069821 0.85 KDM4E (0.52) POLBKDM4EALDH1A1L3MBTL1FABP4
Bromide SCHEMBL3916334 0.84 POLB (0.54) POLBKDM4EALDH1A1L3MBTL1FABP4
SCHEMBL1105809 0.76 KDM4E (0.77) POLBKDM4EKMT2ASMN1; SMN2RECQL
Iodide SCHEMBL2057098 0.75 KDM4E (0.75) POLBKDM4EALDH1A1LMNATHRB
Bromide SCHEMBL3915979 0.75 KDM4E (0.80) POLBKDM4ECYP1A2ALDH1A1LMNA
SCHEMBL15419914 0.75 KDM4E (0.79) POLBKDM4EALDH1A1FABP4KMT2A
Decanoic Acid SCHEMBL26131119 0.72 CYP1A2 (0.52) APEX1CYP1A2ALDH1A1FABP4MEN1
SCHEMBL16663887 0.71 KDM4E (0.81) POLBKDM4EALDH1A1LMNAKMT2A
SCHEMBL6262227 0.70 KDM4E (0.49) POLBKDM4EALDH1A1LMNAFABP4
SCHEMBL7069818 0.69 KDM4E (0.54) POLBKDM4EALDH1A1L3MBTL1LMNA

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-6750346-B2 CHROMENES AS TERMINAL END GROUPS CARL ZEISS JENA GMBH (DE) 2004-06-15 US disclosed
US-20020115862-A1 Stable near-infrared (nir) marker dyes based on benzopyrylium-polymethines DYOMICS GMBH (DE) 2002-08-22 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-20020115862-A1 Stable near-infrared (nir) marker dyes based on benzopyrylium-polymethines CYBA, MKI67, CYP3A5 POLB 1529/4885KDM4E 2204/4885APEX1 1491/4885

“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.