SCHEMBL4094443

SCHEMBL4094443

CN1CC2CC1CN2c1nn(-c2ccnc(NCc3ccccc3)c2)c2cc(F)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.39
MAPK13 O15264 3/20 0.39
MAPK12 P53778 3/20 0.39
MAPK11 Q15759 3/20 0.39
NOS2 P35228 1/20 0.38
CHRNA7 P36544 3/20 0.37
KCNH2 Q12809 3/20 0.37
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM5B Q9UGL1 1/20 0.37
HRH4 Q9H3N8 1/20 0.35
CDK9 P50750 2/20 0.34
CCNT1 O60563 1/20 0.34
BRAF P15056 2/20 0.34
JAK1 P23458 2/20 0.34
CHEK1 O14757 1/20 0.34
ABL1 P00519 1/20 0.34
PRKCB P05771 1/20 0.34
FYN P06241 1/20 0.34
CDK1 P06493 1/20 0.34

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
SCHEMBL4095076 0.91 NOS2 (0.40) MAPK14MAPK13MAPK12MAPK11NOS2
SCHEMBL4100799 0.90 MAPK14 (0.37) MAPK14MAPK13MAPK12MAPK11NOS2
SCHEMBL4091469 0.89 MAPK14 (0.36) MAPK14MAPK13MAPK12MAPK11NOS2
SCHEMBL4090285 0.85 KHK (0.42) MAPK14MAPK13MAPK12MAPK11NOS2
SCHEMBL4089257 0.85 KHK (0.42) MAPK14MAPK13MAPK12MAPK11NOS2
SCHEMBL4094677 0.85 MEN1 (0.36) MAPK14CHRNA7KCNH2HRH4CDK9
SCHEMBL4094568 0.81 NOS2 (0.39) MAPK14NOS2HRH4CDK9CCNT1
SCHEMBL4094799 0.80 NOS2 (0.38) NOS2HRH4CDK9CCNT1CHEK1
SCHEMBL4092528 0.79 PLK1 (0.47) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL4103090 0.79 ITGAL (0.40) MAPK14KDM5AKDM4CKDM5BAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582631-B2 Paget's disease; muscular disorders; cardiovascular disorders; antiinflamamtory agents; antidiabetic agents; autoimmune disease; leukemia AMGEN INC. (US) 2009-09-01 US claimed
US-7582631-B2 Paget's disease; muscular disorders; cardiovascular disorders; antiinflamamtory agents; antidiabetic agents; autoimmune disease; leukemia AMGEN INC. (US) 2009-09-01 US disclosed
US-20090149468-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-06-11 US disclosed
US-20050182072-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-08-18 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-20090149468-A1 Substituted heterocyclic compounds and methods of use HLA-DRB1, PRKDC, NFATC1 MAPK14 1220/4885MAPK13 300/4885MAPK12 756/4885
US-20050182072-A1 Substituted heterocyclic compounds and methods of use HLA-DRB1, PRKDC, NFATC1 MAPK14 964/4885MAPK13 321/4885MAPK12 639/4885

“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.