SCHEMBL16769942

SCHEMBL16769942

CC(C)n1cc(-c2ccc(Oc3cc(F)cc(OCc4cnc(COC5CCCCO5)nc4)c3)cc2)c2c(N)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TEK Q02763 14/20 0.50
▸ KDR P35968 12/20 0.50
▸ LCK P06239 12/20 0.48
▸ SRC P12931 6/20 0.48
▸ RET P07949 2/20 0.41
▸ BTK Q06187 3/20 0.40
▸ FYN P06241 2/20 0.40
▸ EGFR P00533 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ RGS12 O14924 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ GMNN O75496 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ LYN P07948 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40

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
SCHEMBL18925730 0.92 TEK (0.51) TEKKDRLCKSRCRET
SCHEMBL16769806 0.84 TEK (0.66) TEKKDRLCKSRCRET
SCHEMBL16769990 0.84 KDR (0.58) TEKKDRLCKSRCRET
SCHEMBL18925744 0.83 TEK (0.59) TEKKDRLCKSRCEGFR
SCHEMBL16769986 0.83 KDR (0.62) TEKKDRLCKSRCBTK
SCHEMBL16769925 0.82 TEK (0.61) TEKKDRLCKSRCEGFR
SCHEMBL16769999 0.82 TEK (0.64) TEKKDRLCKSRCEGFR
SCHEMBL16769950 0.80 KDR (0.63) TEKKDRLCKSRCRET
SCHEMBL16769952 0.80 TEK (0.71) TEKKDRLCKSRCBTK
SCHEMBL16769955 0.79 KDR (0.66) TEKKDRLCKSRCRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 — — US disclosed
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 — — US disclosed
WO-2015077866-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE INC. (CA) 2015-06-04 — — 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 (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-20170158697-A1 Protein Kinase Inhibitors TEC, LCK, SRC TEK 1662/4885KDR 2463/4885LCK 2/4885

“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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