SCHEMBL5790262

SCHEMBL5790262

CSc1nc(-c2ccncc2)c(-c2cccc(C(F)(F)F)c2)c(=O)n1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.45
MAPK11 Q15759 3/20 0.45
MAPK13 O15264 2/20 0.45
MAPK12 P53778 2/20 0.45
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TGFBR1 P36897 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2B Q13224 2/20 0.42
MAPK9 P45984 2/20 0.42
RAF1 P04049 1/20 0.42
SLC11A2 P49281 1/20 0.41
PTPN11 Q06124 1/20 0.41
MAP4K4 O95819 1/20 0.40
FRK P42685 1/20 0.40
CSNK1A1 P48729 1/20 0.40
CSNK1D P48730 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
SCHEMBL5786467 0.87 MAPK14 (0.44) MAPK14LMNAKDM4EALDH1A1TGFBR1
SCHEMBL5788934 0.84 GRIN1 (0.45) MAPK14MAPK11MAPK13MAPK12LMNA
SCHEMBL6932152 0.84 CSNK1D (0.53) MAPK14MAPK11MAPK13MAPK12LMNA
Hydrochloric Acid SCHEMBL6935269 0.83 GRIN1 (0.45) MAPK14MAPK11MAPK13MAPK12LMNA
SCHEMBL5847695 0.83 ALDH1A1 (0.46) MAPK14MAPK11MAPK13MAPK12LMNA
SCHEMBL6933563 0.82 GRIN1 (0.43) MAPK14MAPK11MAPK13MAPK12TGFBR1
SCHEMBL5788057 0.82 TGFBR1 (0.43) MAPK14MAPK11MAPK13MAPK12TGFBR1
SCHEMBL6933561 0.82 TGFBR1 (0.43) MAPK14MAPK11MAPK13MAPK12TGFBR1
SCHEMBL4816410 0.80 MAPK14 (0.54) MAPK14MAPK11MAPK13MAPK12LMNA
SCHEMBL5791511 0.79 MAPK9 (0.47) MAPK14MAPK11MAPK13MAPK12TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1448564-B1 SUBSTITUTED INDOLIZINE-LIKE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-04-19 EP disclosed
US-6921762-B2 Substituted indolizine-like compounds and methods of use AMGEN INC. (US) 2005-07-26 US disclosed
EP-1448564-A2 SUBSTITUTED INDOLIZINE-LIKE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2004-08-25 EP disclosed
US-6649604-B2 Analgesics; antidiabetic agents; antiinflamamtory agents AMGEN INC. 2003-11-18 US disclosed
EP-1037881-B1 PROCESS OF PREPARING SUBSTITUTED PYRIMIDINONES AMGEN INC (US) 2003-11-12 EP disclosed
US-20030195221-A1 Substituted indolizine-like compounds and methods of use AMGEN INC. 2003-10-16 US disclosed
WO-2003044021-A2 SUBSTITUTED INDOLIZINE-LIKE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2003-05-30 WO disclosed
US-20030073704-A1 Substituted pyridone compounds and methods of use AMGEN INC. 2003-04-17 US disclosed
US-6420385-B1 INFLAMMATORY, PAIN AND DIABETES DISEASES, AMGEN INC. 2002-07-16 US disclosed
EP-1037881-A1 PROCESS OF PREPARING SUBSTITUTED PYRIMIDINONES Amgen Inc. (US) 2000-09-27 EP disclosed
US-6096753-A Substituted pyrimidinone and pyridone compounds and methods of use AMGEN INC. (US) 2000-08-01 US disclosed
EP-0948496-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1999028303-A1 PROCESS OF PREPARING SUBSTITUTED PYRIMIDINONES AMGEN, INC. (US) 1999-06-10 WO disclosed
WO-1998024780-A2 SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 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-20030195221-A1 Substituted indolizine-like compounds and methods of use IL1A, IL1B, IL6 MAPK14 653/4885MAPK11 1140/4885MAPK13 1336/4885
US-20030073704-A1 Substituted pyridone compounds and methods of use IL6, IL1B, IL1A MAPK14 1169/4885MAPK11 1375/4885MAPK13 1577/4885

“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.