SCHEMBL4500736

SCHEMBL4500736

NC(=O)c1cnc(Nc2ccc(OCCN3CCNCC3)c(F)c2)nc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.49
INSR P06213 1/20 0.49
SYK P43405 1/20 0.46
KDR P35968 4/20 0.44
PTK2 Q05397 1/20 0.42
CSF1R P07333 3/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
EGFR P00533 4/20 0.41
TNK2 Q07912 2/20 0.41
BTK Q06187 2/20 0.41
LCK P06239 2/20 0.41
QPCT Q16769 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
SRC P12931 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
SCHEMBL4489929 0.91 AXL (0.57) AXLINSRKDRCSF1RHTR2A
SCHEMBL4499318 0.90 AXL (0.56) AXLINSRKDRCSF1RHTR2A
SCHEMBL4507920 0.89 AXL (0.49) AXLINSRKDRCSF1REGFR
SCHEMBL5689296 0.89 AXL (0.49) AXLINSRKDRCSF1REGFR
SCHEMBL4480188 0.89 AXL (0.59) AXLINSRSYKKDRHTR2A
SCHEMBL4494805 0.86 AXL (0.52) AXLINSRKDRCSF1REGFR
SCHEMBL5689284 0.86 AXL (0.47) AXLINSRKDRCSF1REGFR
SCHEMBL4495092 0.85 AXL (0.51) AXLINSRKDRCSF1REGFR
SCHEMBL4495452 0.85 EGFR (0.48) AXLINSRSYKKDRCSF1R
SCHEMBL5686178 0.85 CSF1R (0.52) AXLINSRKDRCSF1REGFR

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-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
EP-1648464-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINCARBOXAMID DERIVATIVES AND RELATED COMPOUNDS AS T-CELL ACTIVATION INHIBITORS FOR THE TREATMENT OF INFLAMMATIONS AMGEN INC. (US) 2006-04-26 EP disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US disclosed
WO-2005009443-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF T CELL ACTIVATION FOR THE TREATMENT OF INFLAMMATORY DISEASES AMGEN INC. (US) 2005-02-03 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 AXL 2557/4885INSR 998/4885SYK 1151/4885

“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.