SCHEMBL4003706

SCHEMBL4003706

CS(=O)(=O)c1ccccc1S(=O)(=O)Oc1ccc2[nH]nc(I)c2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 4/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ ESR2 Q92731 1/20 0.36
▸ MAPK8 P45983 1/20 0.35
▸ F2 P00734 9/20 0.35
▸ ADORA2B P29275 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NTRK1 P04629 1/20 0.32
▸ CSNK2A1 P68400 1/20 0.32

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
SCHEMBL4004255 0.86 CYP1A2 (0.39) TTKMEN1ESR1KMT2AATM
SCHEMBL4007104 0.85 F2 (0.38) TTKMEN1ESR1KMT2AATM
SCHEMBL4006912 0.85 MEN1 (0.41) TTKMEN1ESR1KMT2AATM
SCHEMBL4007930 0.84 TTK (0.56) TTKMAPK8GAANTRK1CSNK2A1
SCHEMBL4007876 0.82 LRRK2 (0.37) TTKMEN1ESR1KMT2AATM
SCHEMBL4008425 0.81 PRKAG1 (0.40) TTKMAPK8F2NTRK1CSNK2A1
SCHEMBL4010492 0.80 HSD11B1 (0.36) MEN1ESR1KMT2AESR2PTGS2
SCHEMBL4008356 0.79 YTHDC1 (0.53) NTRK1CSNK2A1
SCHEMBL4011763 0.78 ITK (0.57) —
SCHEMBL4013630 0.77 CDK7 (0.53) MAPK8MAPK1NTRK1CSNK2A1

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 4 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
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 TTK 215/4885MEN1 2247/4885ESR1 3077/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 TTK 223/4885MEN1 2443/4885ESR1 3499/4885

“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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