SCHEMBL1437441

SCHEMBL1437441

CCS(=O)(=O)Nc1ccc(F)c(C(=O)O)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 4/20 0.48
PSIP1 O75475 1/20 0.47
BRAF P15056 9/20 0.42
MRGPRX1 Q96LB2 2/20 0.41
BMPR1B O00238 1/20 0.40
PLK4 O00444 1/20 0.40
PIR O00625 1/20 0.40
AURKA O14965 1/20 0.40
DCLK1 O15075 1/20 0.40
EPHB6 O15197 1/20 0.40
RIPK2 O43353 1/20 0.40
STK16 O75716 1/20 0.40
OXSR1 O95747 1/20 0.40
MAP4K4 O95819 1/20 0.40
ABL1 P00519 1/20 0.40
RAF1 P04049 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
FES P07332 1/20 0.40
CSF1R P07333 1/20 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
SCHEMBL913409 0.90 CYP3A4 (0.52) METAP2BRAFBMPR1BPLK4PIR
SCHEMBL9930872 0.87 PSIP1 (0.46) METAP2PSIP1BRAFMRGPRX1BMPR1B
SCHEMBL1462056 0.86 BRAF (0.49) METAP2BRAFBMPR1BPLK4PIR
SCHEMBL1437566 0.85 FABP4 (0.51) METAP2PSIP1BRAFBMPR1BPLK4
SCHEMBL1462961 0.83 BRAF (0.49) METAP2BRAFRAF1CYP2C9
SCHEMBL1462061 0.82 BRAF (0.46) METAP2BRAFFABP4
SCHEMBL1437434 0.79 BRAF (0.46) METAP2PSIP1BRAFMRGPRX1BMPR1B
SCHEMBL9930989 0.78 CYP3A4 (0.51) BRAFBMPR1BPLK4PIRAURKA
SCHEMBL3416027 0.78 METAP2 (0.40) METAP2BRAFBMPR1BPLK4PIR
SCHEMBL1438194 0.77 PSIP1 (0.51) METAP2PSIP1BRAFMRGPRX1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2013-01-17 US disclosed
WO-2012118492-A1 HETEROCYCLIC SULFONAMIDES AS RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-09-07 WO disclosed
EP-2493865-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2012-09-05 EP disclosed
EP-2470538-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2012-07-04 EP disclosed
EP-2470541-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2012-07-04 EP disclosed
US-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
US-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
US-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2012-06-21 US disclosed
WO-2011025938-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
WO-2011025940-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
WO-2011025947-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-03-03 WO disclosed
WO-2011025947-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 (3 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-20130018033-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF METAP2 2970/4885PSIP1 2338/4885BRAF 1/4885
US-20120157439-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF METAP2 2970/4885PSIP1 2338/4885BRAF 1/4885
US-20120157453-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF METAP2 1988/4885PSIP1 2924/4885BRAF 1/4885

“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.