SCHEMBL1552978

SCHEMBL1552978

CCNC(=O)Nc1cc(-c2ccc(C(=O)O)cc2)ccn1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
TYK2 P29597 1/20 0.48
PIK3C3 Q8NEB9 1/20 0.47
CNR1 P21554 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL1553496 0.88 CNR1 (0.60) JAK2JAK1TYK2CNR1
SCHEMBL1553258 0.87 PIK3CA (0.60) JAK2JAK1TYK2CNR1MAPK1
SCHEMBL1553602 0.85 NPC1 (0.53) JAK2JAK1TYK2PIK3C3MAPK1
SCHEMBL5542919 0.85 PIK3C3 (0.57) PIK3C3
SCHEMBL1552425 0.81 DGAT1 (0.53)
SCHEMBL1553491 0.80 PIK3C3 (0.51) JAK2JAK1TYK2PIK3C3MAPK1
SCHEMBL1553547 0.78 ABL1 (0.58)
SCHEMBL1553111 0.76 PIK3C3 (0.51) PIK3C3MAPK1
SCHEMBL27768273 0.76 PIK3C3 (0.45) JAK2JAK1TYK2PIK3C3MAPK1
SCHEMBL1552446 0.76 SYK (0.52) JAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2102199-B1 ANTIBACTERIAL POLYCYCLIC UREA COMPOUNDS ASTRAZENECA AB (SE) 2011-04-27 EP disclosed
US-7674801-B2 Alkyl urea substituted pyridines ASTRAZENECA AB (SE) 2010-03-09 US disclosed
US-7674801-B2 Alkyl urea substituted pyridines ASTRAZENECA AB (SE) 2010-03-09 US disclosed
US-7674801-B2 Alkyl urea substituted pyridines ASTRAZENECA AB (SE) 2010-03-09 US disclosed
US-20080132546-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-06-05 US disclosed
US-20080132546-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-06-05 US disclosed
US-20080132546-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-06-05 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-20080132546-A1 CHEMICAL COMPOUNDS MRPL21, NISCH, ABCB11 JAK2 754/4885JAK1 1019/4885TYK2 3470/4885

“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.