SCHEMBL10100722

SCHEMBL10100722

Cc1c(OCCN2CCCC2)ccc(-n2nnnc2-c2cc(-c3cnn(CC(C)C)c3)cnc2N)c1F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.35
BTK Q06187 1/20 0.35
LRRK2 Q5S007 6/20 0.33
FGFR1 P11362 3/20 0.33
FGFR2 P21802 2/20 0.33
FGFR3 P22607 2/20 0.33
MAPK1 P28482 2/20 0.32
AXL P30530 1/20 0.31
MERTK Q12866 1/20 0.31
ALK Q9UM73 1/20 0.31
MET P08581 2/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BMPR1B O00238 1/20 0.31
ACVRL1 P37023 1/20 0.31
ACVR1 Q04771 1/20 0.31

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
SCHEMBL10100714 0.99 JAK2 (0.34) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100458 0.95 JAK2 (0.35) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100431 0.94 JAK2 (0.35) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100757 0.94 LRRK2 (0.40) LRRK2AXLALKMET
SCHEMBL10100713 0.94 JAK2 (0.36) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100571 0.89 LRRK2 (0.40) LRRK2AXLALKMET
SCHEMBL10100434 0.89 JAK2 (0.36) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100403 0.88 JAK2 (0.36) JAK2BTKLRRK2FGFR1FGFR2
SCHEMBL10100760 0.87 LRRK2 (0.36) JAK2LRRK2FGFR1FGFR2FGFR3
SCHEMBL10100724 0.86 SMN1; SMN2 (0.37) AXLMERTKSMN1; SMN2

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-8518938-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-08-27 US disclosed
US-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-28 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-20120165333-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 JAK2 59/4885BTK 388/4885LRRK2 856/4885

“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.