SCHEMBL4189042

SCHEMBL4189042

CS(=O)(=O)Nc1cccc(-c2cncc(NCc3ccc(F)c(F)c3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 12/20 0.48
CYP3A4 P08684 12/20 0.48
CYP2C19 P33261 11/20 0.48
CYP2D6 P10635 11/20 0.48
ALDH1A1 P00352 8/20 0.48
HSD17B10 Q99714 7/20 0.48
CYP2C9 P11712 7/20 0.48
TSHR P16473 6/20 0.48
USP2 O75604 6/20 0.48
HPGD P15428 5/20 0.48
KDM4E B2RXH2 5/20 0.48
ALOX15 P16050 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
PIP4K2A P48426 2/20 0.47
PIP4K2B P78356 2/20 0.47
PIK3CA P42336 2/20 0.47
EGFR P00533 1/20 0.47
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
MAPK1 P28482 5/20 0.46

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
SCHEMBL4191577 0.87 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL4187248 0.85 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL4191563 0.83 FYN (0.56) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL4185440 0.83 BRAF (0.60) PIP4K2APIP4K2BCYP11B1CYP11B2PARP1
SCHEMBL4192356 0.81 BRAF (0.53) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL4189096 0.81 FYN (0.64) CYP3A4ALDH1A1TDP1CYP11B1CYP11B2
SCHEMBL4196459 0.80 FYN (0.67) CYP1A2CYP3A4CYP2C19CYP2D6ALDH1A1
SCHEMBL4187591 0.79 MEN1 (0.59) MAPTMEN1KMT2APRMT6
SCHEMBL4156327 0.78 CLK1 (0.50) EGFRCYP11B2MAPK1CLK4
SCHEMBL4193131 0.77 MEN1 (0.46) CYP11B1CYP11B2MAPTCLK4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US claimed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP claimed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO claimed
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2020-07-02 US disclosed
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo BROWN DENNIS M (US) 2019-08-20 US disclosed
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2016-08-25 US disclosed
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US disclosed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP disclosed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 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 (4 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-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo NEK9, NEK7, NEK3 CYP1A2 349/4885CYP3A4 257/4885CYP2C19 478/4885
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 CYP1A2 349/4885CYP3A4 257/4885CYP2C19 478/4885
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 CYP1A2 349/4885CYP3A4 257/4885CYP2C19 478/4885
US-20090196912-A1 Pyridinylamines PRNP, PLPBP, SNCA CYP1A2 775/4885CYP3A4 328/4885CYP2C19 181/4885

“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.