SCHEMBL9901775

SCHEMBL9901775

OCc1cc(-c2ncccn2)on1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.58
JAK2 O60674 2/20 0.41
CHEK1 O14757 1/20 0.41
AURKA O14965 1/20 0.41
DAPK3 O43293 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
LCK P06239 1/20 0.41
RET P07949 1/20 0.41
MET P08581 1/20 0.41
PDGFRB P09619 1/20 0.41
PIM1 P11309 1/20 0.41
FGFR1 P11362 1/20 0.41
PDGFRA P16234 1/20 0.41
PRKACA P17612 1/20 0.41
FLT1 P17948 1/20 0.41
LTK P29376 1/20 0.41
GRK5 P34947 1/20 0.41
KDR P35968 1/20 0.41
MAP2K2 P36507 1/20 0.41

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
SCHEMBL9902173 0.85 NOTUM (0.42) NOTUMCHRNB2CHRNA4RAB9ASMN1; SMN2
SCHEMBL19143311 0.81 ADRB2 (0.37) NOTUMRAB9ASMN1; SMN2TDP1ALDH1A1
SCHEMBL2105882 0.79 NOTUM (0.60) NOTUMJAK2CHEK1AURKADAPK3
SCHEMBL9902277 0.78 NOTUM (0.35) NOTUMRAB9ASMN1; SMN2TDP1ALDH1A1
SCHEMBL9903239 0.77 NOTUM (0.34) NOTUMRAB9ASMN1; SMN2TDP1ALDH1A1
SCHEMBL19336747 0.77 RAB9A (0.41) NOTUMRAB9ASMN1; SMN2TDP1ALDH1A1
SCHEMBL19143242 0.77 MAPK1 (0.45) NOTUMJAK2AURKADAPK3PRKD3
SCHEMBL30518383 0.75 NOTUM (0.51) NOTUMJAK2CHEK1AURKADAPK3
SCHEMBL2300064 0.75 NOTUM (0.51) NOTUMJAK2CHEK1AURKADAPK3
SCHEMBL1544128 0.73 NOTUM (1.00) NOTUMJAK2CHEK1AURKADAPK3

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-3216798-A2 KETOLIDE COMPOUNDS Wockhardt Limited (IN) 2017-09-13 EP disclosed
EP-2673285-B1 KETOLIDE COMPOUNDS WOCKHARDT LTD (IN) 2017-07-19 EP disclosed
US-20160083412-A1 KETOLIDE COMPOUNDS WOCKHARDT LIMITED (IN) 2016-03-24 US disclosed
US-9175031-B2 Ketolide compounds WOCKHARDT LIMITED (IN) 2015-11-03 US disclosed
US-20140005133-A1 KETOLIDE COMPOUNDS WOCKHARDT LIMITED (IN) 2014-01-02 US disclosed
EP-2673285-A1 KETOLIDE COMPOUNDS Wockhardt Limited (IN) 2013-12-18 EP disclosed
WO-2012076989-A1 KETOLIDE COMPOUNDS WOCKHARDT LIMITED (IN) 2012-06-14 WO 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 (2 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-20160083412-A1 KETOLIDE COMPOUNDS AKR1C3, AKR1D1, AKR1C1 NOTUM 2272/4885JAK2 3540/4885CHEK1 2972/4885
US-20140005133-A1 KETOLIDE COMPOUNDS AKR1C3, AKR1D1, AKR1C1 NOTUM 1954/4885JAK2 3246/4885CHEK1 2867/4885

“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.