SCHEMBL3217455

SCHEMBL3217455

COC(=O)c1sc(CO)cc1NC(=O)Nc1ccc(C)cc1

nearest known ligand 0.80

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 9/20 0.80
MAPK14 Q16539 15/20 0.70
PKM P14618 1/20 0.60
ATM Q13315 1/20 0.60
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
MAPK13 O15264 1/20 0.52
MAPK12 P53778 1/20 0.52
MAPK11 Q15759 1/20 0.52

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
SCHEMBL2926566 0.89 RAF1 (1.00) RAF1MAPK14PKMATMALDH1A1
SCHEMBL6473441 0.87 RAF1 (0.61) RAF1MAPK14PKMATMALDH1A1
SCHEMBL15298832 0.87 RAF1 (0.75) RAF1MAPK14PKMATMALDH1A1
SCHEMBL15959532 0.82 RAF1 (0.83) RAF1MAPK14PKMATMALDH1A1
SCHEMBL14159719 0.80 MAPK14 (0.66) RAF1MAPK14PKMATMALDH1A1
SCHEMBL3227338 0.80 RAF1 (1.00) RAF1MAPK14PKMATMALDH1A1
SCHEMBL3213560 0.80 MAPK14 (1.00) RAF1MAPK14MAPK13MAPK12MAPK11
SCHEMBL10275911 0.76 RAF1 (0.77) RAF1MAPK14PKMALDH1A1MAPT
SCHEMBL14159658 0.76 RAF1 (0.78) RAF1MAPK14PKMATMALDH1A1
SCHEMBL3217460 0.75 MAPK14 (1.00) RAF1MAPK14MAPK13MAPK12MAPK11

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-20120178780-A1 RAF KINASE INHIBITORS WOOD JILL E (US) 2012-07-12 US disclosed
US-20120178780-A1 RAF KINASE INHIBITORS WOOD JILL E (US) 2012-07-12 US disclosed
US-20120178780-A1 RAF KINASE INHIBITORS WOOD JILL E (US) 2012-07-12 US disclosed
US-20100063088-A1 Raf Kinase Inhibitors WOOD JILL E 2010-03-11 US disclosed
US-20100063088-A1 Raf Kinase Inhibitors WOOD JILL E 2010-03-11 US disclosed
US-20100063088-A1 Raf Kinase Inhibitors WOOD JILL E 2010-03-11 US disclosed
EP-0986382-B1 RAF KINASE INHIBITORS BAYER PHARMACEUTICALS CORP (US) 2008-06-25 EP disclosed
US-20050256174-A1 Raf kinase inhibitors BAYER HEALTHCARE LLC 2005-11-17 US disclosed
US-20010006975-A1 Raf kinase inhibitors BAYER CORPORATION AND ONYX PHARMACEUTICALS WEST HAVEN, CT AND RICHMOND, CA, RESPECTIVELY 2001-07-05 US disclosed
EP-0986382-A4 RAF KINASE INHIBITORS BAYER AG (US) 2001-04-11 EP disclosed
US-6187799-B1 TREATING CANCEROUS CELL GROWTH MEDIATED BY RAF KINASE BY ADMINISTERING SPECIFIED COMPOUNDS, SUCH AS 2-(METHYOXYCARBONYL),3-((4-METHYLPHENYL)UREA),5-ALKYL-THIOPHENE ONYX PHARMACEUTICALS 2001-02-13 US disclosed
EP-0986382-A1 RAF KINASE INHIBITORS Bayer Corporation (US) 2000-03-22 EP disclosed
WO-1998052559-A1 RAF KINASE INHIBITORS BAYER CORPORATION (US) 1998-11-26 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 (4 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-20100063088-A1 Raf Kinase Inhibitors BRAF, RAF1, ARAF RAF1 2/4885MAPK14 239/4885PKM 1684/4885
US-20050256174-A1 Raf kinase inhibitors BRAF, RAF1, ARAF RAF1 2/4885MAPK14 239/4885PKM 1684/4885
US-20120178780-A1 RAF KINASE INHIBITORS BRAF, RAF1, ARAF RAF1 2/4885MAPK14 239/4885PKM 1684/4885
US-20010006975-A1 Raf kinase inhibitors BRAF, RAF1, ARAF RAF1 2/4885MAPK14 239/4885PKM 1684/4885

“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.