SCHEMBL8256286

SCHEMBL8256286

O=C(Nc1ccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)cc1)c1ccco1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITK Q08881 1/20 0.53
▸ PTPN1 P18031 2/20 0.51
▸ PTPN2 P17706 1/20 0.51
▸ PTPN6 P29350 1/20 0.51
▸ PTPN11 Q06124 1/20 0.51
▸ RAB9A P51151 12/20 0.48
▸ MAPT P10636 7/20 0.48
▸ TP53 P04637 6/20 0.48
▸ ATM Q13315 1/20 0.48
▸ NPC1 O15118 11/20 0.47
▸ SMN1; SMN2 Q16637 9/20 0.47
▸ ALDH1A1 P00352 7/20 0.47
▸ KDM4E B2RXH2 6/20 0.47
▸ HSD17B10 Q99714 6/20 0.46
▸ HPGD P15428 5/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ TTK P33981 1/20 0.45
▸ MAPK8 P45983 1/20 0.45
▸ KMT2A Q03164 3/20 0.45

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
SCHEMBL5381719 0.91 ITK (0.51) ITKRAB9AMAPTTP53ATM
SCHEMBL8258052 0.85 ROCK1 (0.57) ITKPTPN1TTKMAPK8
SCHEMBL5394779 0.83 MAP3K5 (0.56) ITKPTPN1PTPN2PTPN6PTPN11
SCHEMBL8252487 0.82 CDK7 (0.52) TTKMAPK8KMT2ALMNA
SCHEMBL5383843 0.82 TTK (0.55) TTKMAPK8
SCHEMBL5376956 0.82 TTK (0.46) ITKMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL5378163 0.82 CSNK1D (0.53) PTPN1PTPN6PTPN11RAB9ANPC1
SCHEMBL5383667 0.82 CSNK1D (0.53) PTPN1PTPN6PTPN11RAB9ANPC1
SCHEMBL5373976 0.81 ITK (0.61) ITKPTPN1PTPN2PTPN6PTPN11
SCHEMBL5372610 0.79 MAP3K5 (0.51) MAPTTTKMAPK8KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds SIGNAL PHARMACEUTICALS, LLC 2007-03-15 — — 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-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 — — 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-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 — — 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 (3 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 ITK 1780/4885PTPN1 719/4885PTPN2 709/4885
US-20070060616-A1 Methods for treating, preventing and managing chronic lymphocytic leukemia with indazole compounds BCL9, MCL1, INMT ITK 1770/4885PTPN1 622/4885PTPN2 677/4885
US-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R ITK 54/4885PTPN1 607/4885PTPN2 686/4885

“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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