SCHEMBL3788091

SCHEMBL3788091

CC(C)(C)n1nc(Oc2cccc(Cl)c2)c2c(N)ncnc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.60
ABL1 P00519 7/20 0.53
EGFR P00533 3/20 0.53
RIPK2 O43353 2/20 0.53
FYN P06241 2/20 0.53
MAPK8 P45983 2/20 0.53
CSNK1D P48730 2/20 0.53
HCK P08631 2/20 0.53
KDR P35968 2/20 0.53
DAPK3 O43293 1/20 0.53
CYP1A2 P05177 1/20 0.53
LCK P06239 1/20 0.53
YES1 P07947 1/20 0.53
LYN P07948 1/20 0.53
PDGFRB P09619 1/20 0.53
FGR P09769 1/20 0.53
CYP2C9 P11712 1/20 0.53
PDGFRA P16234 1/20 0.53
PRKACA P17612 1/20 0.53
EPHB2 P29323 1/20 0.53

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
SCHEMBL13019879 0.87 SRC (0.58) SRCABL1EGFRRIPK2FYN
SCHEMBL13019906 0.87 SRC (0.56) SRCABL1EGFRRIPK2FYN
SCHEMBL13019876 0.87 SRC (0.63) SRCABL1EGFRRIPK2FYN
SCHEMBL13019900 0.86 SRC (0.50) SRCABL1EGFRRIPK2FYN
SCHEMBL13019923 0.86 KDM4E (0.53) SRCABL1EGFRRIPK2FYN
SCHEMBL13019878 0.86 SRC (0.64) SRCABL1EGFRRIPK2FYN
SCHEMBL3779332 0.86 SRC (0.62) SRCABL1EGFRRIPK2FYN
SCHEMBL13019908 0.85 SRC (0.60) SRCABL1EGFRRIPK2FYN
SCHEMBL13019886 0.84 SRC (0.51) SRCABL1EGFRRIPK2FYN
SCHEMBL13019912 0.84 MAPT (0.52) SRCABL1EGFRRIPK2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3430017-B1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES UNIV CALIFORNIA (US) 2023-01-25 EP disclosed
EP-3430017-B1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES UNIV CALIFORNIA (US) 2023-01-25 EP disclosed
US-11208411-B2 Compositions and methods for treating parasitic diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-28 US disclosed
US-11208411-B2 Compositions and methods for treating parasitic diseases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-28 US disclosed
US-20200291030-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-09-17 US disclosed
US-20200291030-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-09-17 US disclosed
EP-3430017-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES The Regents of The University of California (US) 2019-01-23 EP disclosed
WO-2017161344-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES THE REGANTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-09-21 WO disclosed
WO-2017161344-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES THE REGANTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-09-21 WO disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 US disclosed
EP-2217239-A2 MODULATION OF PROTEIN TRAFFICKING Foldrx Pharmaceuticals, Inc. (US) 2010-08-18 EP disclosed
WO-2009062118-A2 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2009-05-14 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 (3 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-20200291030-A1 COMPOSITIONS AND METHODS FOR TREATING PARASITIC DISEASES LIPA, LSS, LIPC SRC 1524/4885ABL1 283/4885EGFR 4811/4885
US-11208411-B2 Compositions and methods for treating parasitic diseases LIPA, LSS, LIPC SRC 1524/4885ABL1 283/4885EGFR 4811/4885
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING RAB1A, COPB1, GOLT1B SRC 1332/4885ABL1 1725/4885EGFR 3921/4885

“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.