SCHEMBL4010147

SCHEMBL4010147

O=C(Nc1n[nH]c2ccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc12)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.50
▸ JAK1 P23458 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.49
▸ ULK1 O75385 1/20 0.49
▸ AAK1 Q2M2I8 1/20 0.49
▸ CDK7 P50613 7/20 0.48
▸ LRRK2 Q5S007 1/20 0.47
▸ FGFR1 P11362 2/20 0.47
▸ FGFR3 P22607 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ FGFR2 P21802 1/20 0.47
▸ RAB9A P51151 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ PGR P06401 1/20 0.46
▸ TP53 P04637 1/20 0.45
▸ CDC7 O00311 1/20 0.45
▸ PLK4 O00444 1/20 0.45
▸ CHEK1 O14757 1/20 0.45
▸ AURKA O14965 1/20 0.45
▸ DCLK1 O15075 1/20 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
SCHEMBL4011476 0.96 HDAC6 (0.49) JAK2JAK1HDAC6ULK1AAK1
SCHEMBL1460604 0.84 MAPT (0.58) JAK2JAK1ULK1AAK1CDK7
SCHEMBL1461738 0.84 JAK2 (0.52) JAK2JAK1ULK1AAK1CDK7
SCHEMBL4008121 0.83 GPR27 (0.55) JAK2JAK1TP53AURKAMAP4K4
SCHEMBL4007934 0.82 MAPT (0.61) JAK2AAK1CDK7FGFR1FGFR3
SCHEMBL4003421 0.82 CDK7 (0.48) JAK2HDAC6ULK1CDK7FGFR1
SCHEMBL1461652 0.80 MAP2K4 (0.60) PGRAURKAMAPK1AURKB
SCHEMBL6490347 0.80 JAK2 (0.52) JAK2JAK1HDAC6ULK1AAK1
SCHEMBL1460525 0.80 LRRK2 (0.53) JAK2JAK1ULK1AAK1CDK7
SCHEMBL4008460 0.80 CDK7 (0.48) JAK2HDAC6ULK1CDK7FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 — — US disclosed
CN-100369899-C Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2008-02-20 — — CN disclosed
CN-1642922-A Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2005-07-20 — — CN disclosed
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-03-17 — — US disclosed
US-6858638-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-02-22 — — US disclosed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 — — 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 (2 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-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 JAK2 262/4885JAK1 304/4885HDAC6 562/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 JAK2 272/4885JAK1 295/4885HDAC6 610/4885

“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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