SCHEMBL5372974

SCHEMBL5372974

O=C(Cc1cccnc1)Nc1ccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ WNT1 P04628 6/20 0.49
▸ ROCK2 O75116 2/20 0.49
▸ DYRK1A Q13627 4/20 0.49
▸ CLK2 P49760 2/20 0.49
▸ CLK3 P49761 2/20 0.49
▸ PSMB8 P28062 1/20 0.48
▸ PDE3B Q13370 1/20 0.47
▸ TTK P33981 3/20 0.46
▸ MAPK8 P45983 1/20 0.45
▸ PORCN Q9H237 1/20 0.43
▸ NAMPT P43490 1/20 0.43
▸ TGFBR1 P36897 1/20 0.42
▸ WNT3A P56704 1/20 0.42
▸ ROCK1 Q13464 1/20 0.42
▸ FGFR4 P22455 1/20 0.42
▸ CDK7 P50613 1/20 0.42

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
SCHEMBL6503337 0.93 TTK (0.48) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL5383843 0.91 TTK (0.55) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL8252487 0.85 CDK7 (0.52) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL5379531 0.82 TTK (0.60) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL5379414 0.81 ITK (0.53) TTKMAPK8ROCK1
SCHEMBL5373186 0.80 ITK (0.52) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL8256286 0.79 ITK (0.53) TTKMAPK8
SCHEMBL8258052 0.78 ROCK1 (0.57) ROCK2DYRK1ACLK2CLK3TTK
SCHEMBL8252322 0.78 TTK (0.51) WNT1ROCK2DYRK1ACLK2CLK3
SCHEMBL8257301 0.77 DYRK1A (0.53) WNT1ROCK2DYRK1ACLK2CLK3

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
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-6855710-B2 Substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-02-15 — — US disclosed
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 — — US 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-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-03-25 — — 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 (7 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 WNT1 1359/4885ROCK2 143/4885DYRK1A 1188/4885
US-20040077877-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 WNT1 1195/4885ROCK2 183/4885DYRK1A 784/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT WNT1 1364/4885ROCK2 1534/4885DYRK1A 1932/4885
US-20050107457-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 WNT1 1340/4885ROCK2 244/4885DYRK1A 726/4885
US-20020103229-A1 Indazole derivatives as JNK inhibitors and compositions and methods related thereto MAP3K7, MAP3K1, MAP3K8 WNT1 1195/4885ROCK2 183/4885DYRK1A 784/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R WNT1 255/4885ROCK2 301/4885DYRK1A 426/4885
US-20040058978-A1 Novel substituted indolines with an inhibitory effect on various kinases and complexes of CDKs CDK1, CDK2, CDK3 WNT1 808/4885ROCK2 1071/4885DYRK1A 257/4885

“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.

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