SCHEMBL17075795

SCHEMBL17075795

O=S(=O)(c1ccc(-c2ccc3ncnc(Nc4ccc(OCc5cccc(F)c5)c(Cl)c4)c3c2)cc1)N1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.65
ERBB2 P04626 17/20 0.65
ABL1 P00519 2/20 0.64
INSR P06213 2/20 0.64
PDGFRB P09619 2/20 0.64
CDK2 P24941 2/20 0.64
PLK1 P53350 2/20 0.64
HDAC1 Q13547 2/20 0.64
HDAC8 Q9BY41 2/20 0.64
HDAC6 Q9UBN7 2/20 0.64
HDAC3 O15379 1/20 0.61
HDAC4 P56524 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HDAC10 Q969S8 1/20 0.61
HDAC11 Q96DB2 1/20 0.61
HDAC9 Q9UKV0 1/20 0.61
HDAC5 Q9UQL6 1/20 0.61

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
SCHEMBL17075850 0.95 EGFR (0.64) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075873 0.93 ERBB2 (0.66) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075832 0.93 ERBB2 (0.69) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075827 0.93 EGFR (0.63) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075815 0.93 EGFR (0.69) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL29563990 0.93 EGFR (0.69) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075830 0.88 EGFR (0.68) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075875 0.88 EGFR (0.69) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075859 0.88 EGFR (0.69) EGFRERBB2ABL1INSRPDGFRB
SCHEMBL17075816 0.86 EGFR (0.69) EGFRERBB2ABL1INSRPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150259331-A1 PROTOZOAN PARASITE GROWTH INHIBITORS THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2015-09-17 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 (1 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-20150259331-A1 PROTOZOAN PARASITE GROWTH INHIBITORS TPP1, MKI67, PIGO EGFR 4389/4885ERBB2 4468/4885ABL1 116/4885

“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.