SCHEMBL2922230

SCHEMBL2922230

Clc1cccc(Nc2c(-c3ccccn3)nc3cnccn23)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.58
▸ BRAF P15056 2/20 0.56
▸ GAA P10253 15/20 0.55
▸ TDP1 Q9NUW8 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ HTT P42858 4/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ NPSR1 Q6W5P4 3/20 0.55
▸ MITF O75030 1/20 0.55
▸ MAPT P10636 10/20 0.53
▸ TP53 P04637 6/20 0.53
▸ POLB P06746 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.51
▸ SYK P43405 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ CDK2 P24941 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ ALOX15 P16050 1/20 0.49

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
SCHEMBL31193353 0.88 BRAF (0.53) BRAFGAATDP1KMT2ASMN1; SMN2
SCHEMBL2921758 0.85 BRAF (0.77) BRAFGAATDP1KMT2ASMN1; SMN2
SCHEMBL2939476 0.83 BRAF (0.66) BRAFGAATDP1KMT2AHTT
SCHEMBL13451490 0.82 BRAF (0.65) BRAFGAATDP1KMT2ASMN1; SMN2
SCHEMBL2922900 0.80 BRAF (0.62) BRAFGAATDP1KMT2AHTT
SCHEMBL27075692 0.80 GAA (0.55) BRAFGAATDP1KMT2ASMN1; SMN2
SCHEMBL2915672 0.80 BRAF (0.60) BRAFGAATDP1KMT2AHTT
SCHEMBL2918444 0.80 SYK (0.73) BRAFGAATDP1KMT2ASMN1; SMN2
SCHEMBL2922748 0.79 BRAF (0.73) PTGS2BRAFGAATDP1KMT2A
SCHEMBL2922345 0.77 GAA (0.65) BRAFGAAKMT2ASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1901748-B1 ANGIOGENESIS INHIBITORS ONCALIS AG (CH) 2010-09-08 — — EP disclosed
EP-1901748-B1 ANGIOGENESIS INHIBITORS ONCALIS AG (CH) 2010-09-08 — — EP disclosed
EP-1765351-B9 PROTEIN KINASE INHIBITORS ONCALIS AG (CH) 2010-03-24 — — EP disclosed
EP-1765351-B9 PROTEIN KINASE INHIBITORS ONCALIS AG (CH) 2010-03-24 — — EP disclosed
EP-1765351-B1 PROTEIN KINASE INHIBITORS ONCALIS AG (CH) 2009-03-04 — — EP disclosed
EP-1765351-B1 PROTEIN KINASE INHIBITORS ONCALIS AG (CH) 2009-03-04 — — EP disclosed
US-20070149535-A1 Protein kinase inhibitors ONCALIS AG (CH) 2007-06-28 — — US disclosed
US-20070149535-A1 Protein kinase inhibitors ONCALIS AG (CH) 2007-06-28 — — 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-20070149535-A1 Protein kinase inhibitors FLT1, ERBB2, ERBB3 PTGS2 985/4885BRAF 42/4885GAA 3677/4885

“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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