SCHEMBL9284438

SCHEMBL9284438

Cc1ccc(Nc2c(NS(=O)(=O)C3CC3)cn(C)c(=O)c2C)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.48
MAP2K1 Q02750 14/20 0.45
MRGPRX1 Q96LB2 3/20 0.41
HRH1 P35367 1/20 0.41
MAP2K2 P36507 1/20 0.41
BRD4 O60885 2/20 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
SCHEMBL18086455 0.92 BRAF (0.48) BRAFMAP2K1MRGPRX1HRH1BRD4
SCHEMBL720442 0.90 MAP2K1 (0.51) BRAFMAP2K1MAP2K2
SCHEMBL12656601 0.83 BRAF (0.39) BRAFMAP2K1MRGPRX1HRH1MAP2K2
SCHEMBL1516484 0.80 MAP2K1 (0.58) BRAFMAP2K1MAP2K2
SCHEMBL1516527 0.80 MAP2K1 (0.45) BRAFMAP2K1MAP2K2
SCHEMBL12407095 0.79 MRGPRX1 (0.51) BRAFMRGPRX1HRH1
SCHEMBL391647 0.78 MRGPRX1 (0.44) BRAFMAP2K1MRGPRX1HRH1MAP2K2
SCHEMBL1516487 0.78 MAP2K1 (0.55) BRAFMAP2K1MAP2K2
SCHEMBL1516512 0.78 BRAF (0.48) BRAFMAP2K1MAP2K2
SCHEMBL12836734 0.78 BRAF (0.48) BRAFMAP2K1BRD4

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-20160271122-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. (US) 2016-09-22 US disclosed
US-9095581-B2 Combinations of MEK inhibitors and Raf kinase inhibitors and uses thereof ARDEA BIOSCIENCES, INC. (US) 2015-08-04 US disclosed
US-20120136030-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. 2012-05-31 US disclosed
WO-2007121481-A2 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES, INC. (US) 2007-10-25 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 (2 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-20120136030-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF BRAF, RAF1, NRAS BRAF 1/4885MAP2K1 71/4885MRGPRX1 2335/4885
US-20160271122-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF BRAF, RAF1, NRAS BRAF 1/4885MAP2K1 71/4885MRGPRX1 2335/4885

“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.