SCHEMBL17700765

SCHEMBL17700765

COc1ccc(Br)cc1CCC(=O)Nc1ccc(S(=O)(=O)C2CC2)c(CN(C)C(=O)OCC[Si](C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
POLB P06746 1/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 2/20 0.36
BRD4 O60885 1/20 0.35

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
SCHEMBL16294225 0.91 LMNA (0.36) LMNAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL16293921 0.90 L3MBTL1 (0.38) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL16294538 0.90 LMNA (0.41) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL16293792 0.90 PTGER1 (0.37) LMNAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL16293924 0.88 LMNA (0.34) LMNAL3MBTL1SMN1; SMN2MAPT
SCHEMBL16293910 0.87 LMNA (0.41) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL16294177 0.87 L3MBTL1 (0.37) LMNAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL16293843 0.87 LMNA (0.38) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL17705220 0.86 LMNA (0.49) LMNAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL18892525 0.83 LMNA (0.47) LMNAMEN1KMT2AALDH1A1L3MBTL1

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-9657006-B2 Macrocyclic factor VIIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-23 US disclosed
US-20160115159-A1 MACROCYCLIC FACTOR VIIA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-04-28 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-20160115159-A1 MACROCYCLIC FACTOR VIIA INHIBITORS F7, F12, F5 LMNA 963/4885POLB 3035/4885MEN1 1244/4885

“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.