SCHEMBL5058374

SCHEMBL5058374

CC(=O)c1c(O)cc(OS(=O)(=O)C(F)(F)F)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.52
HPGD P15428 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPK1 P28482 3/20 0.45
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD11B1 P28845 1/20 0.44
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ABL1 P00519 1/20 0.43
MAPT P10636 1/20 0.43
RECQL P46063 1/20 0.43
RIN1 Q13671 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
THRB P10828 1/20 0.42
CXCR2 P25025 2/20 0.38
CXCR1 P25024 1/20 0.38
ALDH1A1 P00352 2/20 0.35
STS P08842 1/20 0.35

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
SCHEMBL2380488 0.83 HSD11B1 (0.44) CYP3A4HPGDMEN1KMT2AMAPK1
SCHEMBL5236822 0.80 CYP3A4 (0.50) CYP3A4HPGDKMT2AMAPK1USP2
SCHEMBL201845 0.80 CA5A (0.50) HSD11B1CXCR2CXCR1STSCA1
SCHEMBL12151167 0.80 HSD11B1 (0.37) CYP3A4HPGDMEN1KMT2AMAPK1
SCHEMBL200874 0.79 HSD11B1 (0.46) HPGDMEN1KMT2AHSD11B1MAPT
SCHEMBL15349616 0.75 HSD11B1 (0.47) HPGDMEN1KMT2ASMN1; SMN2HSD11B1
SCHEMBL926505 0.74 CA2 (0.41) HSD11B1CXCR2CXCR1CA1CA2
SCHEMBL3829429 0.74 CYP3A4 (0.41) CYP3A4HPGDMEN1KMT2AMAPK1
SCHEMBL24253109 0.72 ERN1 (0.41) CYP3A4HPGDMEN1KMT2AMAPK1
SCHEMBL1713127 0.71 STS (0.62) HPGDMEN1KMT2ASMN1; SMN2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP claimed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US claimed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 WO claimed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP disclosed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US disclosed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 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-20080090782-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 CYP3A4 4226/4885HPGD 1218/4885MEN1 2946/4885
US-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 CYP3A4 4226/4885HPGD 1218/4885MEN1 2946/4885

“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.