SCHEMBL5583098

SCHEMBL5583098

NC(=S)Nc1n[nH]c2c(C(F)(F)F)cccc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.38
▸ EGFR P00533 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ AXL P30530 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ AURKB Q96GD4 1/20 0.33

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
SCHEMBL5582945 0.81 L3MBTL1 (0.39) EGFRL3MBTL1GLASMN1; SMN2KDM4E
SCHEMBL11698454 0.81 KIF11 (0.42) KIF11EGFRL3MBTL1SMN1; SMN2KDM4E
SCHEMBL2661733 0.78 SMN1; SMN2 (0.41) KIF11L3MBTL1GLASMN1; SMN2MAPK1
SCHEMBL2661233 0.74 CHEK1 (0.55) KIF11L3MBTL1SMN1; SMN2KDM4EHSD17B10
SCHEMBL2661393 0.73 CSF1R (0.44) L3MBTL1GLASMN1; SMN2KDM4EHSD17B10
SCHEMBL16252832 0.72 CTNNB1 (0.44) KIF11SMN1; SMN2KDM4EHSD17B10AXL
SCHEMBL20674188 0.72 KIF11 (0.46) KIF11EGFRSMN1; SMN2KDM4EHSD17B10
SCHEMBL5929451 0.71 KDM4E (0.48) L3MBTL1SMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL13122112 0.71 KIF11 (0.47) KIF11EGFRSMN1; SMN2KDM4EHSD17B10
SCHEMBL2661765 0.69 FADS1 (0.52) KIF11MAPK1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244169-A1 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. 2007-10-18 — — US disclosed
US-20070244169-A1 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. 2007-10-18 — — US disclosed
US-20070244169-A1 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. 2007-10-18 — — 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-20070244169-A1 GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 KIF11 3005/4885EGFR 4573/4885L3MBTL1 4625/4885

“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.

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