SCHEMBL4455509

SCHEMBL4455509

CC1(C)OC(=O)N(Cc2ccccc2)C1(C)n1cccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.47
CTSG P08311 2/20 0.47
PRTN3 P24158 1/20 0.47
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 1/20 0.42
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AMPD2 Q01433 1/20 0.36
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
CMA1 P23946 1/20 0.36
CTRC Q99895 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL4455507 0.72 GAA (0.50) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL4482455 0.71 ELANE (0.42) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL28154667 0.66 ELANE (0.47) ELANECTSGPRTN3ALDH1A1LMNA
SCHEMBL1188834 0.64 ALDH1A1 (0.49) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL14828734 0.64 ALDH1A1 (0.49) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL7449986 0.63 ELANE (0.50) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL3318278 0.63 PIK3CD (0.51) ELANECTSGPRTN3KMT2AGAA
SCHEMBL21452893 0.62 GAA (0.45) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL28154666 0.62 ELANE (0.71) ELANECTSGPRTN3ALDH1A1KMT2A
SCHEMBL6049149 0.62 ALDH1A1 (0.50) ELANECTSGPRTN3ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137577-A1 HETEROCYCLIC COMPOUNDS PFIZER INC. 2009-05-28 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-20090137577-A1 HETEROCYCLIC COMPOUNDS CYP2D6, ABCG2, CYP2B6 ELANE 1155/4885CTSG 1928/4885PRTN3 2438/4885

“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.