SCHEMBL15091647

SCHEMBL15091647

F[C@@H]1C[C@@H]1c1cc(Nc2ccnc(Cl)n2)n[nH]1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PAK1 Q13153 7/20 0.52
▸ PAK3 O75914 4/20 0.52
▸ PAK2 Q13177 4/20 0.52
▸ PKN1 Q16512 1/20 0.52
▸ IGF1R P08069 3/20 0.47
▸ PAK4 O96013 3/20 0.46
▸ NEK1 Q96PY6 1/20 0.46
▸ NTRK1 P04629 1/20 0.42

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
SCHEMBL15091388 1.00 PAK1 (0.52) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL15091442 1.00 PAK1 (0.52) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL15091499 1.00 PAK1 (0.52) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL15091653 1.00 PAK1 (0.52) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL1164508 0.83 IGF1R (0.65) PAK1IGF1RPAK4NEK1NTRK1
SCHEMBL15208607 0.82 IGF1R (0.46) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL15208606 0.82 IGF1R (0.46) PAK1PAK3PAK2PKN1IGF1R
SCHEMBL14723558 0.81 PAK1 (0.52) PAK1PAK3PAK2IGF1RPAK4
SCHEMBL14723204 0.81 IGF1R (0.60) PAK1IGF1RPAK4NEK1
SCHEMBL14723540 0.81 IGF1R (0.60) PAK1PAK3PAK2IGF1RPAK4

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-8815877-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2014-08-26 — — US disclosed
US-8815877-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2014-08-26 — — US disclosed
US-20130178486-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2013-07-11 — — US disclosed
US-20130178486-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2013-07-11 — — 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-20130178486-A1 SERINE/THREONINE KINASE INHIBITORS PAK1, AKT1, PAK3 PAK1 1/4885PAK3 3/4885PAK2 14/4885

“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.

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