SCHEMBL17705268

SCHEMBL17705268

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

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 1/20 0.33
BRD4 O60885 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
TERT O14746 3/20 0.31
TSHR P16473 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
SCHEMBL17705225 0.89 MEN1 (0.34) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL17705221 0.88 BRD4 (0.45) LMNASMN1; SMN2ALDH1A1MAPTBRD4
SCHEMBL17705212 0.86 RAB9A (0.40) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL17705269 0.85 LMNA (0.36) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL17705260 0.84 BRD4 (0.34) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL17705232 0.84 LMNA (0.41) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL17705235 0.84 LTA4H (0.41) LMNAMAPTKMT2AMEN1
SCHEMBL17705216 0.81 SMN1; SMN2 (0.42) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL17705215 0.79 TP53 (0.38) LMNASMN1; SMN2ALDH1A1MAPTRAB9A
SCHEMBL18892536 0.77 LMNA (0.34) LMNASMN1; SMN2ALDH1A1MAPTRAB9A

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 963/4885SMN1; SMN2 2965/4885ALDH1A1 2603/4885

“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.