SCHEMBL15617686

SCHEMBL15617686

CC(C)(C)CC(=O)NCC1(O)CCC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
BRD4 O60885 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
P2RX7 Q99572 8/20 0.33
LMNA P02545 1/20 0.33
KCNQ2 O43526 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL26139862 0.92 HPGD (0.39) HPGDMEN1CYP1A2CYP3A4CYP2C19
SCHEMBL19124383 0.82 LMNA (0.37) MEN1KMT2ABRD4P2RX7LMNA
SCHEMBL15427281 0.79 MEN1 (0.41) MEN1KMT2ABRD4P2RX7LMNA
SCHEMBL25573605 0.78
SCHEMBL15617682 0.77 BRD4 (0.35) BRD4P2RX7
SCHEMBL15621584 0.76 LMNA (0.56) BRD4P2RX7LMNA
SCHEMBL19116500 0.76 SMN1; SMN2 (0.42) HPGDMEN1KMT2ABRD4SMN1; SMN2
SCHEMBL15427263 0.75 BRD4 (0.33) BRD4P2RX7LMNA
SCHEMBL22259417 0.75 ALDH1A1 (0.41) BRD4SMN1; SMN2P2RX7
SCHEMBL19151155 0.75 LMNA (0.42) MEN1KMT2ABRD4P2RX7LMNA

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-8680090-B2 Sulfonyl containing benzothiazole inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2014-03-25 US disclosed
US-20140011799-A1 SULFONYL CONTAINING BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY 2014-01-09 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-20140011799-A1 SULFONYL CONTAINING BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE LIPG, LPL, LIPE HPGD 1787/4885MEN1 4770/4885CYP1A2 1281/4885

“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.