SCHEMBL16675424

SCHEMBL16675424

Cc1ncc(COCC(C)(C)C)c(CN)c1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 1/20 0.44
NUDT1 P36639 3/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
ESR1 P03372 1/20 0.35
PTGS1 P23219 1/20 0.35
ACP1 P24666 1/20 0.35
PDE4A P27815 1/20 0.35
P2RX1 P51575 1/20 0.35
P2RX2 Q9UBL9 1/20 0.35
PDXK O00764 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
AOX1 Q06278 1/20 0.34

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
SCHEMBL14646865 0.84 LMNA (0.64) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL16675429 0.80 LMNA (0.59) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL16560502 0.79 LMNA (0.66) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17145379 0.78 LMNA (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL14646864 0.78 LMNA (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8896837 0.78 LMNA (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17120815 0.78 LMNA (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL25664896 0.75 LMNA (0.60) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17145899 0.75 LMNA (0.60) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2683971 0.75 LMNA (0.60) LMNAKDM4EALDH1A1HPGDHSD17B10

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-9403826-B2 Compositions and methods for the treatment of inflammatory disorders CELLIX BIO PRIVATE LIMITED (IN) 2016-08-02 US disclosed
US-20150119409-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF INFLAMMATORY DISORDERS CELLIX BIO PRIVATE LIMITED (IN) 2015-04-30 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-20150119409-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF INFLAMMATORY DISORDERS BRCA1, PTGER1, EPAS1 LMNA 842/4885KDM4E 4392/4885ALDH1A1 538/4885

“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.