SCHEMBL10189370

SCHEMBL10189370

CCOC(=O)Cn1nnc(C(C)(C)C)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.61
PKM P14618 1/20 0.61
ATM Q13315 1/20 0.61
ALDH1A1 P00352 4/20 0.51
MAPK1 P28482 2/20 0.51
NPSR1 Q6W5P4 2/20 0.49
MAPT P10636 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.39
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ELANE P08246 1/20 0.37

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
SCHEMBL1829056 0.86 HSD17B10 (0.60) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL15706622 0.80 HSD17B10 (0.69) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL15702911 0.78 SMN1; SMN2 (0.44) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL14641240 0.78 HSD17B10 (0.79) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL11947615 0.78 ALDH1A1 (0.72) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL13361501 0.75 PKM (0.61) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL10128630 0.74 PKM (0.60) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL18839891 0.73 PKM (0.81) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL2441708 0.73 HSD17B10 (0.71) HSD17B10PKMATMALDH1A1MAPK1
SCHEMBL18839729 0.72 PKM (0.60) HSD17B10PKMATMALDH1A1MAPK1

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-9765030-B2 Benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-09-19 US disclosed
US-8097594-B2 Macrolides and ketolides having antimicrobial activity WOCKHARDT LTD. (IN) 2012-01-17 US disclosed
US-20090247478-A1 Novel macrolides and ketolides having antimicrobial activity SINDKHEDKAR MILIND DATTATRAYA 2009-10-01 US disclosed
US-20070015758-A1 Novel benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2007-01-18 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 (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-20090247478-A1 Novel macrolides and ketolides having antimicrobial activity CYP51A1, CASP12, LSS HSD17B10 335/4885PKM 761/4885ATM 4413/4885
US-20070015758-A1 Novel benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors CETP, NPC1, DBI HSD17B10 354/4885PKM 1184/4885ATM 3415/4885

“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.