SCHEMBL4010904

SCHEMBL4010904

O=S(=O)(Oc1cccc(F)c1)c1ccc2[nH]nc(-c3ccccc3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K4 P45985 8/20 0.47
▸ TTK P33981 8/20 0.46
▸ HPGD P15428 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAP2K7 O14733 2/20 0.44
▸ AURKB Q96GD4 2/20 0.44
▸ DCLK1 O15075 1/20 0.44
▸ PRKD3 O94806 1/20 0.44
▸ MAP4K4 O95819 1/20 0.44
▸ CHEK2 O96017 1/20 0.44
▸ CSF1R P07333 1/20 0.44
▸ FER P16591 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ MARK3 P27448 1/20 0.44
▸ FLT4 P35916 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ CSNK1D P48730 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ CSNK2A1 P68400 1/20 0.44

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
SCHEMBL4004440 0.91 TTK (0.52) MAP2K4TTKHPGDMAPTMAP2K7
SCHEMBL4013332 0.85 GPR17 (0.40) MAP2K4TTKMAP2K7KDM4E
SCHEMBL4013454 0.84 GPR17 (0.37) MAP2K4TTKMAP2K7
SCHEMBL4009643 0.84 TDP1 (0.38) MAP2K4TTKHPGDMAP2K7MAPK8
SCHEMBL4010010 0.84 GPR17 (0.37) MAP2K4TTKMAP2K7MAPK8
SCHEMBL4006453 0.82 APEX1 (0.50) MAP2K4TTKHPGDMAPTAURKB
SCHEMBL4009669 0.81 NTRK1 (0.41) MAP2K4TTKMAPTMAP2K7NTRK3
SCHEMBL4008126 0.80 NTRK1 (0.44) MAP2K4MAPTMAP2K7PRKD3MAP4K4
SCHEMBL4006003 0.80 APEX1 (0.53) MAP2K4TTKHPGDMAPTAURKB
SCHEMBL4013301 0.79 FLT3 (0.51) MAPTMAP4K4CDK2MARK3FLT3

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
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
EP-1487803-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY Aventis Pharma S.A. (FR) 2004-12-22 — — EP disclosed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 — — US disclosed
WO-2003078402-A1 INDAZOLES SUBSTITUTED WITH AN ANTI-CANCEROUS ACTIVITY AVENTIS PHARMA S.A. (FR) 2003-09-25 — — WO 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 MAP2K4 340/4885TTK 215/4885HPGD 1246/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 MAP2K4 328/4885TTK 223/4885HPGD 1303/4885

“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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