SCHEMBL17119700

SCHEMBL17119700

CC(C)c1cc2cnc(Cl)cc2n(CCO)c1=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTK Q06187 7/20 0.46
SRC P12931 5/20 0.45
LYN P07948 3/20 0.45
TRPC5 Q9UL62 3/20 0.40
CCR9 P51686 2/20 0.39
MAT2A P31153 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 1/20 0.34
BRD4 O60885 1/20 0.34
MCHR1 Q99705 2/20 0.32
CYP11B2 P19099 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32

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
SCHEMBL17119698 0.85 BTK (0.61) BTKSRCLYNCCR9HSD17B10
SCHEMBL17120948 0.81 SRC (0.45) BTKSRCLYNCCR9HSD17B10
SCHEMBL17119687 0.72 BTK (0.67) BTKSRCLYN
SCHEMBL24667112 0.72 BTK (0.47) BTKLYNCCR9HSD17B10BRD4
SCHEMBL17119666 0.72 BTK (0.51) BTKSRCLYNMAT2AHSD17B10
SCHEMBL17119672 0.68 BTK (0.46) BTKSRCLYNCCR9BRD4
SCHEMBL21842176 0.67 SRC (0.50) BTKSRCLYNCCR9
SCHEMBL24666962 0.67 BTK (0.42) BTKSRCLYNCCR9BRD4
SCHEMBL24666954 0.67 BTK (0.43) BTKSRCLYNCCR9HSD17B10
SCHEMBL4249593 0.66 CCR9 (0.48) CCR9MAT2AHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714247-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-9714247-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 US disclosed
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-04-20 US disclosed
US-9493454-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2016-11-15 US disclosed
US-9493454-B2 Multiple kinase pathway inhibitors TOLERO PHARMACEUTICALS, INC. (US) 2016-11-15 US disclosed
US-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MANNKIND CORPORATION 2015-09-24 US disclosed
US-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MANNKIND CORPORATION 2015-09-24 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 (2 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-20150266870-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 BTK 245/4885SRC 161/4885LYN 330/4885
US-20170107215-A1 MULTIPLE KINASE PATHWAY INHIBITORS MAP3K6, MAP3K2, MAP3K1 BTK 245/4885SRC 161/4885LYN 330/4885

“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.