SCHEMBL5389772

SCHEMBL5389772

CSc1nc(Nc2ccc(N3CCOCC3)cc2)cc(N2CCN(C(=O)c3ccncc3)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
JAK2 O60674 2/20 0.45
FLT3 P36888 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
AKR1C3 P42330 1/20 0.45
KDR P35968 4/20 0.44
BRAF P15056 2/20 0.44
NAMPT P43490 1/20 0.44
RAF1 P04049 1/20 0.44
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
FGFR1 P11362 1/20 0.44
TEK Q02763 1/20 0.44
KHK P50053 1/20 0.44
RAB9A P51151 1/20 0.43
GBA1 P04062 1/20 0.43
AURKA O14965 2/20 0.43
MAPK14 Q16539 1/20 0.43

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
SCHEMBL5386316 0.91 SMN1; SMN2 (0.50) MAPTJAK2FLT3ALDH1A1SMN1; SMN2
SCHEMBL25386656 0.84 KDR (0.45) MAPTJAK2FLT3SMN1; SMN2KDR
SCHEMBL26938050 0.83 GALR2 (0.48) MAPTJAK2ALDH1A1SMN1; SMN2KDR
SCHEMBL5387423 0.83 AURKA (0.42) MAPTJAK2FLT3SMN1; SMN2KDR
SCHEMBL5402668 0.81 AURKA (0.48) MAPTALDH1A1SMN1; SMN2KDRBRAF
SCHEMBL5820813 0.81 NAMPT (0.47) MAPTALDH1A1KDRBRAFNAMPT
SCHEMBL5820251 0.81 CYP1A2 (0.45) MAPTALDH1A1GAASMN1; SMN2KDR
SCHEMBL29091968 0.81 MAPT (0.49) MAPTJAK2ALDH1A1GAAKDR
SCHEMBL5823039 0.81 AURKA (0.50) ALDH1A1KDRBRAFNAMPTRAF1
SCHEMBL5823980 0.81 ZAP70 (0.49) MAPTJAK2ALDH1A1GAAKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276501-B2 6-(4-substituted-anilino)pyrimidine derivatives, method for preparation thereof and antiviral pharmaceutical composition comprising the same B & C BIOPHARM (KR) 2007-10-02 US disclosed
EP-1490358-A4 6-(4-SUBSTITUTED-ANILINO)PYRIMIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF AND ANTIVIRAL PHARMACEUTICAL COMPOSITION COMPRISING THE SAME B & C BIOPHARM (KR) 2006-04-12 EP disclosed
US-20050222150-A1 6-(4-substituted-anilino)pyrimidine derivates, method for preparation thereof and antiviral pharmaceutical composition comprising the same B & C BIOPHARM (KR) 2005-10-06 US disclosed
EP-1490358-A1 6-(4-SUBSTITUTED-ANILINO)PYRIMIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF AND ANTIVIRAL PHARMACEUTICAL COMPOSITION COMPRISING THE SAME B & C Biopharm (KR) 2004-12-29 EP disclosed
WO-2003084953-A1 6-(4-SUBSTITUTED-ANILINO)PYRIMIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF AND ANTIVIRAL PHARMACEUTICAL COMPOSITION COMPRISING THE SAME B & C BIOPHARM (KR) 2003-10-16 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-20050222150-A1 6-(4-substituted-anilino)pyrimidine derivates, method for preparation thereof and antiviral pharmaceutical composition comprising the same HAVCR2, NUDT1, GART MAPT 4588/4885JAK2 836/4885FLT3 1980/4885

“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.