SCHEMBL7087811

SCHEMBL7087811

CN(c1ncnc2[nH]cc(-c3cccc(Cl)c3)c12)C1CCCCC1.CNC1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STK4 Q13043 13/20 0.63
STK3 Q13188 13/20 0.63
LRRK2 Q5S007 11/20 0.62
TP53 P04637 2/20 0.55
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
JAK3 P52333 1/20 0.43

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
SCHEMBL3539127 0.94 STK4 (0.71) STK4STK3LRRK2TP53JAK2
SCHEMBL3537467 0.82 LRRK2 (0.67) STK4STK3LRRK2TP53JAK2
SCHEMBL7087807 0.81 STK4 (0.64) STK4STK3LRRK2
SCHEMBL31301542 0.78 STK4 (1.00) STK4STK3LRRK2
SCHEMBL31301652 0.77 LRRK2 (1.00) STK4STK3LRRK2JAK2JAK3
SCHEMBL3542500 0.76 LRRK2 (0.58) STK4STK3LRRK2JAK2JAK1
SCHEMBL3539122 0.74 STK3 (0.60) STK4STK3LRRK2
SCHEMBL3536209 0.74 JAK3 (0.56) LRRK2TP53JAK2JAK1JAK3
SCHEMBL3536056 0.74 JAK3 (0.56) LRRK2TP53JAK2JAK1JAK3
SCHEMBL31301635 0.73 STK4 (0.84) STK4STK3LRRK2JAK2JAK3

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-20030212273-A1 Pyrrolo [2,3-D] pyrimidine compounds PFIZER INC. 2003-11-13 US disclosed
US-6610847-B2 Tyrosine kinase inhibitors; immunosuppressants PFIZER INC. 2003-08-26 US disclosed
EP-1087970-A1 PYRROLO 2,3-d]PYRIMIDINE COMPOUNDS Pfizer Products Inc. (US) 2001-04-04 EP disclosed
WO-1999065908-A1 PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS PFIZER PRODUCTS INC. (US) 1999-12-23 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-20030212273-A1 Pyrrolo [2,3-D] pyrimidine compounds JAK1, JAK3, JAK2 STK4 425/4885STK3 211/4885LRRK2 972/4885

“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.