SCHEMBL5345802

SCHEMBL5345802

COC(=O)Nc1nc2cc(Sc3ccc(NC(=O)Nc4cc(OC)cc(OC)c4)cc3)ccc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.57
CYP1A2 P05177 3/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
NR1I2 O75469 1/20 0.57
MAPK14 Q16539 1/20 0.57
KDR P35968 11/20 0.56
TEK Q02763 10/20 0.56
MMP1 P03956 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.47
CYP2C19 P33261 1/20 0.47
HIF1A Q16665 1/20 0.47
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
KCNH2 Q12809 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7104626 0.92 MEN1 (0.49) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL14375459 0.92 LMNA (0.69) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL11879658 0.87 LMNA (0.66) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL5348312 0.85 TEK (0.67) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL5348784 0.85 KDR (0.67) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL5347361 0.84 TEK (0.58) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL5345014 0.83 KDR (0.67) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL24359553 0.83 LMNA (0.66) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL23077831 0.82 LMNA (0.60) LMNACYP1A2MEN1KMT2ANR1I2
SCHEMBL11872088 0.82 LMNA (0.65) LMNACYP1A2MEN1KMT2ANR1I2

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-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US claimed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 US claimed
US-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 US disclosed
US-7238813-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-07-03 US disclosed
US-20040082583-A1 Chemical compounds SMITHKLINE BEECHAM CORPORATION 2004-04-29 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 (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-20070249600-A1 CHEMICAL COMPOUNDS TIE1, KDR, FLT4 LMNA 2801/4885CYP1A2 1291/4885MEN1 760/4885
US-20040082583-A1 Chemical compounds TIE1, KDR, FLT4 LMNA 2801/4885CYP1A2 1291/4885MEN1 760/4885

“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.