SCHEMBL4498728

SCHEMBL4498728

O=C(OCCCO)c1cc2cccc(Cl)c2n2nnnc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 2/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PKM P14618 1/20 0.34
TSHR P16473 3/20 0.33
USP2 O75604 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
HPGD P15428 1/20 0.32
TP53 P04637 1/20 0.32
PDE2A O00408 3/20 0.31
KDM4E B2RXH2 2/20 0.31
TDP1 Q9NUW8 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 1/20 0.31
CCR2 P41597 1/20 0.31
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL4485651 0.96 ALDH1A1 (0.36) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL4501498 0.94 ALDH1A1 (0.35) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL5142018 0.91 ALDH1A1 (0.46) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL4493629 0.87 TSHR (0.42) ALDH1A1LMNAMAPTNPSR1PKM
SCHEMBL4502554 0.86 MAPT (0.43) ALDH1A1LMNAMAPTKMT2APKM
SCHEMBL4501185 0.85 FNTA (0.34) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL4502155 0.79 CCR2 (0.39) ALDH1A1LMNAMAPTKMT2APKM
SCHEMBL5101854 0.76 HDAC6 (0.40) ALDH1A1LMNAMAPTPKMTSHR
SCHEMBL4499734 0.75 LMNA (0.42) ALDH1A1LMNAMAPTKMT2ANPSR1
SCHEMBL4507371 0.75 ALDH1A1 (0.35) ALDH1A1LMNAMAPTPKMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-7358259-B2 Tetrazoloquinoline, triazoloquinoline, and oxazoloquinoline compounds, e.g., 9-chloro-N-isopropoxytetrazolo[1,5-a]quinoline-4-carboxamide RIGEL PHARMACEUTICALS, INC. (US) 2008-04-15 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 US disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 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-20070149520-A1 HCV Inhibitors And Methods Of Using Them HAVCR2, GLS2, EIF2AK2 ALDH1A1 874/4885LMNA 3994/4885MAPT 4435/4885

“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.