SCHEMBL613005

SCHEMBL613005

Oc1ccc(Cl)c(-c2ccc3nc(Nc4ccc(OC(F)(F)F)cc4)nn3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.44
TTK P33981 3/20 0.43
CHRNA7 P36544 5/20 0.42
ABL1 P00519 5/20 0.41
JAK2 O60674 1/20 0.41
CTSC P53634 1/20 0.39
CIT O14578 1/20 0.37
GAK O14976 1/20 0.37
EPHB6 O15197 1/20 0.37
RIPK2 O43353 1/20 0.37
PRKD3 O94806 1/20 0.37
LCK P06239 1/20 0.37
YES1 P07947 1/20 0.37
RET P07949 1/20 0.37
PDGFRB P09619 1/20 0.37
BCR P11274 1/20 0.37
SRC P12931 1/20 0.37
BRAF P15056 1/20 0.37
EPHA2 P29317 1/20 0.37
EPHB2 P29323 1/20 0.37

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
SCHEMBL613040 0.85 LRRK2 (0.52) LRRK2TTKABL1JAK2CIT
SCHEMBL612376 0.85 SRC (0.46) LRRK2TTKABL1JAK2CIT
SCHEMBL41292 0.83 LRRK2 (0.49) LRRK2TTKABL1JAK2PDGFRB
SCHEMBL615192 0.82 LRRK2 (0.48) LRRK2TTKABL1JAK2CIT
SCHEMBL613379 0.82 LRRK2 (0.47) LRRK2TTKABL1JAK2CIT
SCHEMBL41597 0.82 LRRK2 (0.47) LRRK2TTKABL1JAK2YES1
SCHEMBL614357 0.81 SYK (0.43) LRRK2TTKABL1JAK2CIT
SCHEMBL613798 0.81 ESR1 (0.45) LRRK2TTKABL1JAK2CIT
SCHEMBL41482 0.80 LRRK2 (0.46) LRRK2TTKJAK2PDGFRBSRC
SCHEMBL612713 0.80 TTK (0.67) LRRK2TTKABL1JAK2SRC

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-20120041195-A1 Heterocyclic compounds FOVEA PHARMACEUTICALS 2012-02-16 US claimed
US-20120041195-A1 Heterocyclic compounds FOVEA PHARMACEUTICALS 2012-02-16 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-20120041195-A1 Heterocyclic compounds MAP3K1, MAP3K5, MAP3K2 LRRK2 391/4885TTK 277/4885CHRNA7 4352/4885

“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.