SCHEMBL4764648

SCHEMBL4764648

Nc1nccc(C=Cc2c(-c3ccccc3)nc3n2CCS3)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEK Q02763 11/20 1.00
KDR P35968 8/20 1.00
FLT1 P17948 6/20 1.00
GRM4 Q14833 3/20 0.47
HDAC6 Q9UBN7 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL4764646 1.00 TEK (1.00) TEKKDRFLT1GRM4HDAC6
SCHEMBL4769755 0.82 TEK (0.69) TEKKDRFLT1GRM4MEN1
SCHEMBL4769750 0.82 TEK (0.69) TEKKDRFLT1GRM4MEN1
SCHEMBL4770175 0.74 MEN1 (0.59) TEKKDRFLT1MEN1KMT2A
SCHEMBL6249637 0.73 TEK (0.65) TEKKDRFLT1MEN1KMT2A
SCHEMBL9744026 0.72 MAPT (0.58) TEKKDRFLT1MEN1KMT2A
SCHEMBL4769255 0.72 TEK (1.00) TEKKDRFLT1GRM4HDAC6
SCHEMBL4769246 0.72 TEK (1.00) TEKKDRFLT1GRM4HDAC6
SCHEMBL4764883 0.72 TEK (1.00) TEKKDRFLT1GRM4
SCHEMBL4764887 0.72 TEK (1.00) TEKKDRFLT1GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575963-B1 ANTI-ANGIOGENETIC THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-05-07 EP disclosed
US-20060069109-A1 Therapeutic agents ASTRAZENECA AB (SE) 2006-03-30 US disclosed
EP-1575963-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2005-09-21 EP disclosed
WO-2004058776-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-15 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-20060069109-A1 Therapeutic agents TIE1, TEK, KDR TEK 2/4885KDR 3/4885FLT1 4/4885

“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.