SCHEMBL5377769

SCHEMBL5377769

COCCC(=O)Nc1cccc(-c2nn(C3CCCCO3)c3ccc(C#N)cc23)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CREBBP Q92793 2/20 0.40
KMT2A Q03164 1/20 0.39
MAP4K4 O95819 1/20 0.39
TSHR P16473 1/20 0.39
BACE1 P56817 2/20 0.38
BACE2 Q9Y5Z0 1/20 0.38
RORC P51449 4/20 0.38
BRD4 O60885 1/20 0.37
ACHE P22303 1/20 0.36
TP53 P04637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
ITK Q08881 1/20 0.35
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35

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
SCHEMBL5381394 0.92 IKBKB (0.41) L3MBTL1CREBBPKMT2ATSHRBACE1
SCHEMBL5373415 0.88 KMT2A (0.40) L3MBTL1CREBBPKMT2ATSHRBACE1
SCHEMBL5377521 0.88 RORC (0.42) L3MBTL1CREBBPKMT2ATSHRBACE1
SCHEMBL5377812 0.83 MAPT (0.46) CREBBPKMT2ATSHRALDH1A1POLB
SCHEMBL5377071 0.83 CREBBP (0.43) CREBBPKMT2ATSHRALDH1A1POLB
SCHEMBL5378434 0.82 CREBBP (0.41) CREBBP
SCHEMBL5372805 0.82 CREBBP (0.45) CREBBPKMT2ARORCTP53ALDH1A1
SCHEMBL5377703 0.81 MEN1 (0.43) CREBBPKMT2ATSHRALDH1A1POLB
SCHEMBL5379526 0.81 TSHR (0.41) CREBBPKMT2ATSHRBACE1ACHE
SCHEMBL5372777 0.80 HPGD (0.40) TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220771-B2 Methods of using indazole derivatives as JNK inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-22 US disclosed
US-7211594-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-05-01 US disclosed
US-7208513-B2 Indazole compounds and compositions thereof as JNK inhibitors and for the treatment of diseases associated therewith SIGNAL PHARMACEUTICALS, LLC (US) 2007-04-24 US disclosed
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 US disclosed
EP-1618093-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS Signal Pharmaceuticals LLC (US) 2006-01-25 EP disclosed
US-6897231-B2 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. (US) 2005-05-24 US disclosed
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SINGNAL PHARMACEUTICALS, INC. 2005-05-19 US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 US disclosed
WO-2004094388-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2004-11-04 WO disclosed
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 US disclosed
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, INC. 2004-04-22 US disclosed
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto SIGNAL PHARMACEUTICALS, LLC 2002-08-01 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 (6 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-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK MAPK1, MAP3K1, MAPKAPK2 EGLN2 3590/4885L3MBTL1 2642/4885CREBBP 144/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 EGLN2 3122/4885L3MBTL1 3141/4885CREBBP 273/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT EGLN2 829/4885L3MBTL1 1035/4885CREBBP 1177/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 EGLN2 2653/4885L3MBTL1 3245/4885CREBBP 216/4885
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 EGLN2 3122/4885L3MBTL1 3141/4885CREBBP 273/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R EGLN2 1235/4885L3MBTL1 3842/4885CREBBP 432/4885

“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.