SCHEMBL13613569

SCHEMBL13613569

Nc1ncc(-c2nccs2)c2sc(-c3ccccc3)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.50
JAK1 P23458 7/20 0.50
TYK2 P29597 7/20 0.50
JAK3 P52333 6/20 0.50
PDPK1 O15530 1/20 0.45
MAP3K8 P41279 2/20 0.43
IKBKB O14920 1/20 0.43
MAPK1 P28482 1/20 0.42
MAP2K1 Q02750 1/20 0.42
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
CHEK2 O96017 1/20 0.39
CYP2A6 P11509 1/20 0.38
PTP4A3 O75365 1/20 0.38
PTP4A2 Q12974 1/20 0.38
PTP4A1 Q93096 1/20 0.38
MEN1 O00255 1/20 0.38
KDR P35968 1/20 0.38
LIMK1 P53667 1/20 0.37
HPGD P15428 2/20 0.36

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
SCHEMBL3826251 0.75 DYRK1A (0.56) JAK2JAK3PDPK1MAP2K1ADORA2A
SCHEMBL5774666 0.71 JAK2 (0.54) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL5469860 0.70 JAK2 (0.73) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL13606545 0.70 JAK2 (0.56) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL5550318 0.69 MAP3K8 (0.53) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL4509363 0.69 JAK2 (0.76) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL13606542 0.69 JAK2 (0.58) JAK2JAK1TYK2JAK3MAP3K8
SCHEMBL20609434 0.67 PDPK1 (0.56) PDPK1ADORA2AADORA1CYP2A6KDR
SCHEMBL14447663 0.67 JAK2 (1.00) JAK2JAK1TYK2JAK3IKBKB
SCHEMBL2175845 0.66 PDPK1 (0.70) PDPK1ADORA2AADORA1CYP2A6KDR

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
US-7635695-B2 Antiinflammation agents AMGEN INC. (US) 2009-12-22 US disclosed
US-20070155777-A1 Antiinflammation agents AMGEN, INC. 2007-07-05 US disclosed
US-20070155777-A1 Antiinflammation agents AMGEN, INC. 2007-07-05 US disclosed
US-7199119-B2 Antiinflammation agents AMGEN INC. (US) 2007-04-03 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-20070155777-A1 Antiinflammation agents TNF, NFATC1, NFKBIA JAK2 1101/4885JAK1 1726/4885TYK2 2825/4885

“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.