SCHEMBL1298205

SCHEMBL1298205

CCOC(=O)C1CCN(c2nc(Nc3ccc(C(F)(F)F)cc3)c3c(=O)[nH]ccc3n2)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.60
TACR2 P21452 1/20 0.44
JAK2 O60674 12/20 0.43
JAK1 P23458 7/20 0.43
SYK P43405 7/20 0.42
DGAT1 O75907 2/20 0.41
TYK2 P29597 1/20 0.41
JAK3 P52333 1/20 0.41
TRPV1 Q8NER1 1/20 0.41

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
SCHEMBL12103666 0.88 LRRK2 (0.65) LRRK2TACR2JAK2JAK1SYK
SCHEMBL1298400 0.85 LRRK2 (0.79) LRRK2TACR2JAK2JAK1SYK
SCHEMBL1298351 0.84 LRRK2 (0.66) LRRK2TACR2JAK2JAK1SYK
SCHEMBL12103499 0.82 LRRK2 (0.67) LRRK2TACR2JAK2JAK1SYK
SCHEMBL1298308 0.82 LRRK2 (0.58) LRRK2JAK2JAK1SYKTYK2
Hydrochloric Acid SCHEMBL1298960 0.82 LRRK2 (0.66) LRRK2TACR2JAK2JAK1SYK
SCHEMBL1298418 0.81 LRRK2 (0.61) LRRK2TACR2JAK2JAK1SYK
SCHEMBL1298580 0.81 LRRK2 (0.57) LRRK2JAK2JAK1SYKTYK2
SCHEMBL1298562 0.80 LRRK2 (0.62) LRRK2TACR2JAK2SYKTRPV1
SCHEMBL1298764 0.79 LRRK2 (0.60) LRRK2JAK2SYKTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404677-B2 Kinase inhibitors GENOSCO (US) 2013-03-26 US claimed
US-8404677-B2 Kinase inhibitors GENOSCO (US) 2013-03-26 US disclosed
US-8404677-B2 Kinase inhibitors GENOSCO (US) 2013-03-26 US disclosed
US-20110269739-A1 KINASE INHIBITORS OSCOTEC, INC. (KR) 2011-11-03 US disclosed
US-20110269739-A1 KINASE INHIBITORS OSCOTEC, INC. (KR) 2011-11-03 US disclosed
WO-2011053861-A1 KINASE INHIBITORS GENOSCO (US) 2011-05-05 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-20110269739-A1 KINASE INHIBITORS JAK1, LCK, MAP3K20 LRRK2 436/4885TACR2 3488/4885JAK2 86/4885

“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.