SCHEMBL17328019

SCHEMBL17328019

C#Cc1cccc(Nc2ncnc3cc(OCCOCCNC(=O)COc4ccc(Cn5c(=O)oc6ccc(C)cc65)cc4O)c(OCCOC)cc23)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 18/20 0.53
▸ ERBB2 P04626 7/20 0.51
▸ GAK O14976 2/20 0.51
▸ RIPK2 O43353 2/20 0.51
▸ BUB1 O43683 2/20 0.51
▸ STK10 O94804 2/20 0.51
▸ ABL1 P00519 2/20 0.51
▸ LCK P06239 2/20 0.51
▸ LYN P07948 2/20 0.51
▸ RET P07949 2/20 0.51
▸ SRC P12931 2/20 0.51
▸ FGFR2 P21802 2/20 0.51
▸ FECH P22830 2/20 0.51
▸ KDR P35968 2/20 0.51
▸ FLT3 P36888 2/20 0.51
▸ MAP3K1 Q13233 2/20 0.51
▸ PLK4 O00444 1/20 0.51
▸ CIT O14578 1/20 0.51
▸ AURKA O14965 1/20 0.51
▸ EPHB6 O15197 1/20 0.51

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
SCHEMBL17328028 1.00 EGFR (0.53) EGFRERBB2GAKRIPK2BUB1
SCHEMBL18400008 0.86 EGFR (0.43) EGFRERBB2GAKRIPK2BUB1
SCHEMBL17327988 0.85 EGFR (0.49) EGFRERBB2RETKDRLMNA
SCHEMBL16305164 0.84 EGFR (0.53) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL16305169 0.83 EGFR (0.50) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL16305160 0.78 EGFR (0.53) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL16297199 0.77 EGFR (0.53) EGFRERBB2KDRHDAC3HDAC4
SCHEMBL10118463 0.74 ERBB2 (0.83) EGFRERBB2GAKRIPK2BUB1
SCHEMBL15365221 0.74 EGFR (0.94) EGFRERBB2GAKRIPK2BUB1
SCHEMBL15365443 0.74 EGFR (0.94) EGFRERBB2GAKRIPK2BUB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9549988-B2 Pharmaceutical compounds targeted by MIF affinity-tethered moieties RJS Biologics (US) 2017-01-24 — — US disclosed
US-20150352217-A1 Pharmaceutical Compounds Targeted by MIF Affinity-Tethered Moieties RJS BIOLOGICS LLC 2015-12-10 — — 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-20150352217-A1 Pharmaceutical Compounds Targeted by MIF Affinity-Tethered Moieties MIF, HMGB2, HMGB1 EGFR 1994/4885ERBB2 1829/4885GAK 1327/4885

“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.

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