SCHEMBL17705269

SCHEMBL17705269

CN(C)Cc1cc(NC(=O)CCc2cc(Br)ccc2C2CC2)ccc1S(=O)(=O)C1CC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
EGFR P00533 2/20 0.34
POLB P06746 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GSTO1 P78417 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TERT O14746 3/20 0.33
ATAD2 Q6PL18 2/20 0.33
CECR2 Q9BXF3 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
GRK2 P25098 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33

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
SCHEMBL17705224 0.88 L3MBTL1 (0.39) LMNAALDH1A1L3MBTL1POLBTP53
SCHEMBL17705220 0.86 LMNA (0.49) LMNAALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL17705210 0.86 GAA (0.42) LMNAALDH1A1L3MBTL1POLBMAPT
SCHEMBL17705268 0.85 LMNA (0.33) LMNAALDH1A1MAPTSMN1; SMN2TERT
SCHEMBL17705261 0.82 LMNA (0.38) LMNAALDH1A1L3MBTL1POLBMAPT
SCHEMBL17705234 0.81 LRRK2 (0.42) LMNAALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL17705251 0.81 LMNA (0.39) LMNAALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL18892529 0.80 L3MBTL1 (0.37) LMNAALDH1A1L3MBTL1POLBTP53
SCHEMBL17705231 0.79 LMNA (0.44) LMNAALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL18892525 0.78 LMNA (0.47) LMNAALDH1A1L3MBTL1MAPTSMN1; SMN2

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 963/4885ALDH1A1 2603/4885L3MBTL1 3810/4885

“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.