SCHEMBL41711

SCHEMBL41711

OCCn1cnc2ccc(Nc3nc4ccc(-c5cc(O)ccc5Cl)cn4n3)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.38
LRRK2 Q5S007 3/20 0.38
TTK P33981 3/20 0.37
JAK2 O60674 1/20 0.35
ABL1 P00519 2/20 0.34
YES1 P07947 2/20 0.34
KDR P35968 2/20 0.34
CIT O14578 1/20 0.34
GAK O14976 1/20 0.34
EPHB6 O15197 1/20 0.34
RIPK2 O43353 1/20 0.34
PRKD3 O94806 1/20 0.34
LCK P06239 1/20 0.34
RET P07949 1/20 0.34
PDGFRB P09619 1/20 0.34
BCR P11274 1/20 0.34
BRAF P15056 1/20 0.34
EPHA2 P29317 1/20 0.34
EPHB2 P29323 1/20 0.34
TYK2 P29597 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
SCHEMBL612376 0.79 SRC (0.46) SRCLRRK2TTKJAK2ABL1
SCHEMBL41596 0.79 LRRK2 (0.43) SRCLRRK2TTKJAK2ABL1
SCHEMBL613379 0.79 LRRK2 (0.47) SRCLRRK2TTKJAK2ABL1
SCHEMBL41148 0.79 JAK2 (0.41) SRCLRRK2TTKJAK2TYK2
SCHEMBL41063 0.78 JAK2 (0.44) SRCLRRK2TTKJAK2ABL1
SCHEMBL42778 0.78 LRRK2 (0.41) SRCLRRK2TTKJAK2ABL1
SCHEMBL40873 0.77 LRRK2 (0.44) SRCLRRK2TTKJAK2ABL1
SCHEMBL41008 0.77 LRRK2 (0.44) SRCLRRK2TTKJAK2ABL1
SCHEMBL613388 0.77 LRRK2 (0.47) SRCLRRK2TTKJAK2ABL1
SCHEMBL41603 0.76 SRC (0.63) SRCJAK2ABL1YES1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130123271-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2013-05-16 US claimed
EP-2585439-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION Fovea Pharmaceuticals (FR) 2013-05-01 EP claimed
WO-2011161159-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2011-12-29 WO claimed
US-20130123271-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2013-05-16 US disclosed
US-20130123271-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2013-05-16 US disclosed
US-20130123271-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2013-05-16 US disclosed
EP-2585439-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION Fovea Pharmaceuticals (FR) 2013-05-01 EP disclosed
WO-2011161159-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2011-12-29 WO disclosed
WO-2011161159-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION FOVEA PHARMACEUTICALS (FR) 2011-12-29 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-20130123271-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THERAPEUTIC APPLICATION CAMK2D, CAMK2A, CAMK2B SRC 401/4885LRRK2 167/4885TTK 342/4885

“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.