SCHEMBL8554665

SCHEMBL8554665

NCC(CN1CCC(Oc2cc(F)cc(C(=O)N3CCCC3)c2)CC1)n1cc(-c2ncnc3[nH]ccc23)cn1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 2/20 0.53
JAK2 O60674 18/20 0.52
JAK1 P23458 10/20 0.52
AXL P30530 1/20 0.51
MERTK Q12866 1/20 0.51

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
SCHEMBL9947531 0.99 TYRO3 (0.52) TYRO3JAK2JAK1AXLMERTK
SCHEMBL8585439 0.94 TYRO3 (0.51) TYRO3JAK2JAK1AXLMERTK
SCHEMBL9897071 0.93 TYRO3 (0.62) TYRO3JAK2JAK1AXLMERTK
SCHEMBL8617863 0.92 TYRO3 (0.62) TYRO3JAK2JAK1AXLMERTK
SCHEMBL9947526 0.91 JAK2 (0.51) TYRO3JAK2JAK1AXLMERTK
SCHEMBL8586705 0.91 TYRO3 (0.48) TYRO3JAK2JAK1AXLMERTK
SCHEMBL9947527 0.90 TYRO3 (0.48) TYRO3JAK2JAK1AXLMERTK
SCHEMBL9947530 0.90 TYRO3 (0.48) TYRO3JAK2JAK1AXLMERTK
Trifluoroacetic Acid SCHEMBL9899375 0.90 TYRO3 (0.59) TYRO3JAK2JAK1AXLMERTK
SCHEMBL9947520 0.90 TYRO3 (0.48) TYRO3JAK2JAK1AXLMERTK

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-20120149682-A1 HETEROCYCLIC-SUBSTITUTED PYRROLOPYRIDINES AND PYRROLOPYRIMIDINES AS JAK INHIBITORS INCYTE CORPORATION 2012-06-14 US disclosed
WO-2012068440-A1 HETEROCYCLIC-SUBSTITUTED PYRROLOPYRIDINES AND PYRROLOPYRIMIDINES AS JAK INHIBITORS INCYTE CORPORATION (US) 2012-05-24 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-20120149682-A1 HETEROCYCLIC-SUBSTITUTED PYRROLOPYRIDINES AND PYRROLOPYRIMIDINES AS JAK INHIBITORS JAK2, JAK1, JAK3 TYRO3 74/4885JAK2 1/4885JAK1 2/4885

“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.