SCHEMBL18268660

SCHEMBL18268660

Cc1ncc(COc2cc(F)cc(Oc3ccc(-c4nn([C@@H]5CCCNC5)c5ncnc(N)c45)cc3)c2)cn1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 11/20 0.53
▸ LCK P06239 2/20 0.51
▸ LYN P07948 1/20 0.51
▸ SRC P12931 9/20 0.49
▸ EGFR P00533 7/20 0.49
▸ PIK3CD O00329 7/20 0.49
▸ KDR P35968 7/20 0.49
▸ ABL1 P00519 6/20 0.49
▸ HCK P08631 6/20 0.49
▸ PIK3CA P42336 6/20 0.49
▸ PIK3CB P42338 6/20 0.49
▸ MTOR P42345 6/20 0.49
▸ PIK3CG P48736 6/20 0.49
▸ PRKDC P78527 6/20 0.49
▸ PI4KB Q9UBF8 6/20 0.49
▸ EPHB4 P54760 5/20 0.49
▸ NUDT14 O95848 1/20 0.47
▸ NUDT5 Q9UKK9 1/20 0.47
▸ TEK Q02763 1/20 0.45

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
SCHEMBL18268991 0.96 BTK (0.55) BTKLCKLYNSRCEGFR
SCHEMBL15613529 0.92 BTK (0.61) BTKLCKLYNSRCEGFR
SCHEMBL18269007 0.91 SRC (0.57) BTKLCKLYNSRCEGFR
SCHEMBL13860255 0.88 BTK (0.63) BTKLCKLYNSRCEGFR
SCHEMBL15613558 0.87 BTK (0.52) BTKLCKLYNSRCEGFR
SCHEMBL18269008 0.87 BTK (0.52) BTKLCKLYNSRCEGFR
SCHEMBL18269166 0.86 BTK (0.52) BTKLCKLYNSRCEGFR
SCHEMBL16769981 0.86 SRC (0.58) BTKLCKLYNSRCEGFR
SCHEMBL16769800 0.86 SRC (0.58) BTKLCKLYNSRCEGFR
SCHEMBL18268690 0.85 BTK (0.56) BTKLCKLYNEGFR

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-20180179210-A1 Inhibitors of the TEC Kinase Enzyme Family PHARMASCIENCE INC. (CA) 2018-06-28 — — US disclosed
WO-2016187723-A1 INHIBITORS OF THE TEC KINASE ENZYME FAMILY PHARMASCIENCE INC. (CA) 2016-12-01 — — 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-20180179210-A1 Inhibitors of the TEC Kinase Enzyme Family TEC, BTK, LCK BTK 2/4885LCK 3/4885LYN 10/4885

“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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