SCHEMBL5456870

SCHEMBL5456870

COc1ccccc1NC(=O)Nc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.64
JAK2 O60674 6/20 0.53
JAK3 P52333 6/20 0.53
PTK2 Q05397 6/20 0.53
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
TP53 P04637 1/20 0.49
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TGFBR1 P36897 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 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
SCHEMBL5459789 0.87 NAMPT (0.56) NAMPTJAK2JAK3PTK2RAB9A
SCHEMBL5458069 0.87 NAMPT (0.65) NAMPTJAK2JAK3PTK2RAB9A
SCHEMBL5458362 0.86 RAB9A (0.58) RAB9ANPC1MAPTALDH1A1LMNA
SCHEMBL5466754 0.85 NAMPT (0.61) NAMPTJAK2JAK3PTK2RAB9A
SCHEMBL5460804 0.84 MAPT (0.68) NAMPTRAB9ANPC1MAPTALDH1A1
SCHEMBL7667693 0.82 NAMPT (0.69) NAMPTJAK2JAK3PTK2RAB9A
SCHEMBL1989165 0.81 NAMPT (0.65) NAMPTJAK3RAB9ANPC1MAPT
SCHEMBL1989164 0.81 NAMPT (0.65) NAMPTJAK3RAB9ANPC1MAPT
SCHEMBL16835041 0.81 NAMPT (0.67) NAMPTJAK2JAK3PTK2RAB9A
SCHEMBL10127488 0.79 NAMPT (0.71) NAMPTJAK2JAK3PTK2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 EP 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 NAMPT 324/4885JAK2 3780/4885JAK3 3773/4885

“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.