SCHEMBL3936362

SCHEMBL3936362

CC(=O)Nc1cc(-c2cccc3c2ccn3[Si](C(C)C)(C(C)C)C(C)C)cc(S(=O)(=O)c2cccnc2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 11/20 0.42
CKS1B P61024 1/20 0.37
SKP2 Q13309 1/20 0.37
MAPT P10636 1/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
PTK2 Q05397 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
TTK P33981 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 1/20 0.35
FEN1 P39748 1/20 0.35
PIK3C3 Q8NEB9 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL3937667 0.85 BRAF (0.39) MAPTJAK2JAK3PTK2LMNA
SCHEMBL3931607 0.82 HTT (0.39) MAPTHPGDSMN1; SMN2
SCHEMBL3929802 0.78 HPGDS (0.50) NAMPTTTKPIK3C3
SCHEMBL3928721 0.75 MAPK10 (0.42) NAMPTCKS1BSKP2MAPTHPGD
SCHEMBL3931771 0.74 HTT (0.38) MAPTSMN1; SMN2PIK3C3
SCHEMBL3938426 0.73 TSHR (0.42) MAPTGAAHPGDSMN1; SMN2CYP2C9
SCHEMBL3929172 0.73 PTGER1 (0.35) JAK3PIK3C3
SCHEMBL3933028 0.72 MAPK14 (0.36) PIK3C3CYP2C9
SCHEMBL3925535 0.71 MAPT (0.51) NAMPTMAPTGAAHPGDLMNA
SCHEMBL3930000 0.67 KMT2A (0.35) MAPTLMNASMN1; SMN2CYP2C9

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-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US disclosed
US-7504401-B2 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2009-03-17 US disclosed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US disclosed
WO-2008008059-A1 ANTI-CANCER AGENTS ANS USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2008-01-17 WO disclosed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 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 (3 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-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 NAMPT 3423/4885CKS1B 133/4885SKP2 1192/4885
US-20060270686-A1 Anti-cancer agents and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 NAMPT 3328/4885CKS1B 139/4885SKP2 1149/4885
US-20080280891-A1 Anti-cancer agents and uses thereof NR2E3, RB1, CBR3 NAMPT 1529/4885CKS1B 127/4885SKP2 924/4885

“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.