SCHEMBL16769926

SCHEMBL16769926

Cc1ncc(COc2cc(F)cc(Oc3ccc(-c4cn(C[C@H]5CCCN5)c5ncnc(N)c45)cc3)c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 15/20 0.47
▸ LCK P06239 6/20 0.43
▸ SRC P12931 6/20 0.43
▸ FYN P06241 2/20 0.43
▸ LYN P07948 2/20 0.43
▸ YES1 P07947 1/20 0.43
▸ HCK P08631 1/20 0.43
▸ FGR P09769 1/20 0.43
▸ TEC P42680 1/20 0.43
▸ TXK P42681 1/20 0.43
▸ BLK P51451 1/20 0.43
▸ BMX P51813 1/20 0.43
▸ ERBB4 Q15303 1/20 0.43
▸ TEK Q02763 3/20 0.41
▸ 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

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
SCHEMBL16769953 1.00 BTK (0.47) BTKLCKSRCFYNLYN
SCHEMBL16769951 0.88 BTK (0.43) BTKLCKSRCFYNLYN
SCHEMBL18268628 0.86 SRC (0.53) BTKLCKSRCHCKEGFR
SCHEMBL16769796 0.83 BTK (0.55) BTKLCKSRCFYNLYN
SCHEMBL16769800 0.83 SRC (0.58) BTKLCKSRCFYNLYN
SCHEMBL16769981 0.83 SRC (0.58) BTKLCKSRCFYNLYN
SCHEMBL18925740 0.81 BTK (0.53) BTKLCKSRCFYNLYN
SCHEMBL15516278 0.80 LCK (0.63) BTKLCKSRCFYNLYN
SCHEMBL15516277 0.80 LCK (0.63) BTKLCKSRCFYNLYN
SCHEMBL16769962 0.79 LCK (0.63) BTKLCKSRCFYNLYN

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 BTK 6/4885LCK 2/4885SRC 3/4885

“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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