SCHEMBL2932403

SCHEMBL2932403

Cc1ccc(C(=O)O)cc1Nc1cncc(-c2ccc(O)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.53
AKR1C3 P42330 1/20 0.53
BRAF P15056 5/20 0.48
CHEK1 O14757 3/20 0.48
RAF1 P04049 1/20 0.44
LDHA P00338 1/20 0.44
LDHB P07195 1/20 0.44
PTPN1 P18031 1/20 0.43
FYN P06241 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PIK3CA P42336 1/20 0.41
PIK3CG P48736 1/20 0.41
AKR1B1 P15121 1/20 0.40
MAPT P10636 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
SCHEMBL2934370 0.86 PIM3 (0.51) PIM3BRAFCHEK1RAF1LDHA
SCHEMBL2928592 0.85 PIM3 (0.71) PIM3BRAFCHEK1RAF1PIK3CG
SCHEMBL2927502 0.84 PIM3 (0.51) PIM3BRAFCHEK1RAF1LDHA
SCHEMBL2933572 0.83 PIM3 (0.63) PIM3BRAFCHEK1RAF1PIK3CG
SCHEMBL13515277 0.82 FASN (0.50) PIM3BRAFCHEK1
SCHEMBL2932274 0.80 PIM3 (0.56) PIM3BRAFCHEK1RAF1FYN
Trifluoroacetic Acid SCHEMBL2931457 0.79 FASN (0.46) PIM3CHEK1
SCHEMBL2930599 0.79 BRAF (0.56) PIM3BRAFCHEK1LDHALDHB
SCHEMBL13515309 0.77 MCHR1 (0.44) PIM3BRAF
SCHEMBL2932655 0.75 CHEK1 (0.72) PIM3CHEK1KDM4EAKR1B1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 WO disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 PIM3 2131/4885AKR1C3 1094/4885BRAF 524/4885

“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.