SCHEMBL14904017

SCHEMBL14904017

COc1cc(-c2cnc3cccc(-c4ccc(-c5ccccc5)cc4)c3c2)cc(OS(=O)(=O)C(F)(F)F)c1OC

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FYN P06241 8/20 0.45
MAPK10 P53779 2/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
TYK2 P29597 1/20 0.44
JAK3 P52333 1/20 0.44
MAP3K11 Q16584 4/20 0.42
GAK O14976 1/20 0.41
TGFBR1 P36897 1/20 0.40
ACVR1 Q04771 1/20 0.40
KIT P10721 2/20 0.39
AAK1 Q2M2I8 1/20 0.39
CHEK2 O96017 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39

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
SCHEMBL9989302 0.83 PDGFRB (0.54) FYNJAK2JAK1TYK2JAK3
SCHEMBL12074840 0.81 FYN (0.49) FYNMAPK10MAP3K11GAKKIT
SCHEMBL12074838 0.79 MAPK10 (0.43) MAPK10
SCHEMBL29213981 0.79 MET (0.41) MAPK10PDGFRBPDGFRA
SCHEMBL12074839 0.78 FYN (0.53) FYNMAP3K11GAKTGFBR1ACVR1
SCHEMBL12074221 0.76 PDGFRB (0.58) GAKPDGFRBPDGFRA
SCHEMBL14892069 0.73 PDGFRB (0.48) FYNJAK2JAK1TYK2JAK3
SCHEMBL14903996 0.73 PDGFRB (0.44) FYNGAKCHEK2PDGFRBPDGFRA
SCHEMBL12074703 0.72 BRD4 (0.44) FYNMAP3K11GAKTGFBR1ACVR1
SCHEMBL9989152 0.71 PDGFRB (0.44) FYNGAKPDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102617-B2 Antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-08-11 US disclosed
US-9102617-B2 Antimicrobial agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2015-08-11 US disclosed
US-20130109713-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY 2013-05-02 US disclosed
US-20130109713-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY 2013-05-02 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-20130109713-A1 ANTIMICROBIAL AGENTS RPS4X, RPS4Y1, MRPL21 FYN 4551/4885MAPK10 1881/4885JAK2 958/4885

“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.