SCHEMBL521848

SCHEMBL521848

Nc1ccc2c(c1)NC(=O)C(NC(=O)C(F)(F)F)CC2

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 8/20 0.51
DDB1 Q16531 2/20 0.45
IKZF3 Q9UKT9 1/20 0.45
CA9 Q16790 1/20 0.45
PYGL P06737 5/20 0.43
PYGM P11217 5/20 0.43
TRPV1 Q8NER1 1/20 0.41
RIPK1 Q13546 5/20 0.40

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
SCHEMBL6260142 0.80 HTR1A (0.43) CRBNCA9TRPV1
SCHEMBL2062606 0.79 INSR (0.46) CRBN
SCHEMBL7791600 0.72 CRBN (0.49) CRBNDDB1IKZF3PYGLPYGM
SCHEMBL3442063 0.71 MTNR1A (0.46)
SCHEMBL15956894 0.71 PYGL (0.50) CRBNDDB1PYGLPYGMRIPK1
SCHEMBL2062702 0.71 CA9 (0.44) CRBNDDB1IKZF3CA9PYGL
SCHEMBL29754050 0.70 CA9 (0.42) CRBNCA9TRPV1
SCHEMBL15957097 0.70 RIPK1 (0.51) CRBNDDB1PYGLPYGMRIPK1
SCHEMBL25584389 0.70 RIPK1 (0.51) PYGLPYGMRIPK1
SCHEMBL8330863 0.70 RIPK1 (0.45) CRBNDDB1PYGLPYGMTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376491-B1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON INC (US) 2015-03-04 EP disclosed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US disclosed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 US disclosed
EP-2376491-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS Cephalon, Inc. (US) 2011-10-19 EP disclosed
WO-2010071885-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2010-06-24 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-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS JAK2, ALK, ABL1 CRBN 2150/4885DDB1 2982/4885IKZF3 88/4885

“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.