SCHEMBL5465717

SCHEMBL5465717

C1CSC(CCN2CCOCC2)CN1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.35
SYK P43405 1/20 0.35
KCNH2 Q12809 1/20 0.35
KEAP1 Q14145 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CA2 P00918 1/20 0.32
GLA P06280 1/20 0.32
CYP1A2 P05177 1/20 0.31
DAO P14920 1/20 0.30

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
SCHEMBL27297870 0.83 KDR (0.36) KDRSYKKCNH2ALDH1A1
SCHEMBL5465794 0.81 KDR (0.35) KDRSYKKCNH2KEAP1SMN1; SMN2
SCHEMBL5465799 0.74 KEAP1 (0.32) KEAP1SMN1; SMN2KDM4EALDH1A1
SCHEMBL18579046 0.71 GNAO1 (0.37) KEAP1SMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL18505991 0.71 GNAO1 (0.37) KEAP1SMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL18505992 0.71 GNAO1 (0.37) KEAP1SMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL5465714 0.71
SCHEMBL28661527 0.70 CXCR4 (0.48) KEAP1SMN1; SMN2KDM4EALDH1A1CA2
SCHEMBL28969434 0.70 SLC6A2 (0.42) KEAP1SMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL18497400 0.70 ALDH1A1 (0.42) KEAP1SMN1; SMN2KDM4EALDH1A1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043010-A1 Quinazoline derivatives ASTRAZENECA UK LIMITED (GB) 2007-02-22 US 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-20070043010-A1 Quinazoline derivatives ERBB2, ABL1, EGFR KDR 101/4885SYK 648/4885KCNH2 3904/4885

“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.