SCHEMBL2962005

SCHEMBL2962005

Cc1cc2cc(Br)cnc2n1S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
LMNA P02545 2/20 0.47
ENPP3 O14638 3/20 0.46
ENPP1 P22413 2/20 0.46
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MMP2 P08253 1/20 0.36

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
SCHEMBL29606592 0.93 ENPP3 (0.54) GAALMNAENPP3ENPP1KDM4E
SCHEMBL7515939 0.90 ENPP3 (0.50) GAALMNAENPP3ENPP1KDM4E
SCHEMBL30280392 0.81 ENPP3 (0.48) GAALMNAENPP3ENPP1MEN1
SCHEMBL26969492 0.79 ALDH3A1 (0.44) GAALMNAENPP3ENPP1KDM4E
SCHEMBL30280398 0.79 ENPP3 (0.47) GAALMNAENPP3ENPP1KDM4E
SCHEMBL30280410 0.79 ENPP3 (0.47) GAALMNAENPP3ENPP1KDM4E
SCHEMBL15774088 0.79 ENPP3 (0.41) LMNAENPP3ENPP1KDM4EMEN1
SCHEMBL30280426 0.78 ENPP3 (0.46) GAALMNAENPP3ENPP1MEN1
SCHEMBL20502417 0.78 ENPP3 (0.48) GAALMNAENPP3ENPP1KDM4E
SCHEMBL13199781 0.78 GAA (0.46) GAALMNAENPP3ENPP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
US-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
EP-2183243-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS Pfizer Inc. (US) 2010-05-12 EP disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 US disclosed
WO-2009016460-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS PFIZER INC. (US) 2009-02-05 WO disclosed
WO-2009016460-A2 PYRAZOLE COMPOUNDS AND THEIR USE AS RAF INHIBITORS PFIZER INC. (US) 2009-02-05 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-20090221608-A1 PYRAZOLE COMPOUNDS BRAF, RAF1, NRAS GAA 2870/4885LMNA 4718/4885ENPP3 2496/4885

“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.