SCHEMBL1490935

SCHEMBL1490935

O=[N+]([O-])c1cnc2cc(-c3ccc(F)cc3)nn2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 12/20 0.51
FTO Q9C0B1 4/20 0.51
MAPT P10636 4/20 0.49
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
KIT P10721 1/20 0.45
HSPB1 P04792 1/20 0.41
ALOX12 P18054 1/20 0.41
PTGS1 P23219 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 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
SCHEMBL1493336 0.87 ALKBH5 (0.61) ALKBH5FTOMAPTMEN1KMT2A
SCHEMBL1493267 0.87 ALKBH5 (0.51) ALKBH5FTOMAPTMEN1KMT2A
SCHEMBL1493314 0.86 MAPT (0.63) ALKBH5FTOMAPTALDH1A1
SCHEMBL1493371 0.86 ALKBH5 (0.63) ALKBH5FTOMAPTMEN1KMT2A
SCHEMBL1493265 0.82 ALKBH5 (0.53) ALKBH5FTOMAPT
SCHEMBL1493335 0.79 MAPT (0.45) ALKBH5FTOMAPT
SCHEMBL30512046 0.78 ALKBH5 (0.85) ALKBH5FTOMAPTALDH1A1
SCHEMBL30512076 0.76 ALKBH5 (0.61) ALKBH5FTOMAPTMEN1KMT2A
SCHEMBL30512071 0.76 MAPT (0.67) ALKBH5FTOMAPTALDH1A1KIT
SCHEMBL1493316 0.76 KIT (0.46) MAPTMEN1KMT2AALDH1A1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2470539-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2012-07-04 EP disclosed
US-20120157451-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC (US) 2012-06-21 US disclosed
WO-2011025951-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 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-20120157451-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF ALKBH5 4874/4885FTO 4701/4885MAPT 900/4885

“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.