SCHEMBL2952886

SCHEMBL2952886

COC(=O)c1ccc(-c2ccc(CN3CCOCC3)cc2OC)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
MAPK1 P28482 3/20 0.62
KMT2A Q03164 2/20 0.55
HIF1A Q16665 1/20 0.53
EPAS1 Q99814 1/20 0.53
HTT P42858 1/20 0.52
LMNA P02545 2/20 0.52
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
TP53 P04637 1/20 0.52
TSHR P16473 2/20 0.51
MAPT P10636 1/20 0.51
STAT3 P40763 1/20 0.51
CHKA P35790 1/20 0.50
ALDH1A1 P00352 1/20 0.49
PDE4B Q07343 1/20 0.49

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
SCHEMBL2951704 0.89 SMN1; SMN2 (0.52) SMN1; SMN2MAPK1KMT2ATSHRALDH1A1
SCHEMBL2944876 0.88 CHKA (0.66) SMN1; SMN2MAPK1KMT2ALMNACHKA
SCHEMBL2949603 0.87 BCL2 (0.52) SMN1; SMN2MAPK1LMNATSHRALDH1A1
SCHEMBL2950008 0.85 HTT (0.66) SMN1; SMN2MAPK1KMT2AHTTMAPT
SCHEMBL2942660 0.83 FKBP1A (0.56) SMN1; SMN2MAPK1KMT2AHTTRAB9A
SCHEMBL171628 0.83 SMN1; SMN2 (0.81) SMN1; SMN2MAPK1KMT2AHIF1AEPAS1
SCHEMBL1013959 0.81 HTT (0.59) SMN1; SMN2MAPK1KMT2AHIF1AEPAS1
SCHEMBL3002785 0.80 SMN1; SMN2 (0.75) SMN1; SMN2MAPK1KMT2AHIF1AEPAS1
SCHEMBL2952031 0.79 EGFR (0.51) SMN1; SMN2KMT2AHTTRAB9ANPC1
SCHEMBL2949961 0.78 CHKA (0.56) KMT2ALMNAMAPTCHKAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754886-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2010-07-13 US disclosed
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2009-05-28 US disclosed
US-7504512-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-03-17 US disclosed
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed
US-20040192681-A1 N-acylsulfonamide apoptosis promoters ABBVIE INC. 2004-09-30 US disclosed
US-6720338-B2 BCL-X1 INHIBITING COMPOSITIONS AND METHODS OF PROMOTING APOPTOSIS IN A MAMMAL ABBOTT LABORATORIES 2004-04-13 US disclosed
US-20020086887-A1 N-Acylsulfonamide apoptosis promoters ABBVIE INC. 2002-07-04 US disclosed
US-20020055631-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2002-05-09 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 (4 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-20020086887-A1 N-Acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 SMN1; SMN2 1440/4885MAPK1 2657/4885KMT2A 2902/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 SMN1; SMN2 1656/4885MAPK1 2730/4885KMT2A 2895/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 SMN1; SMN2 1440/4885MAPK1 2657/4885KMT2A 2902/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR SMN1; SMN2 1713/4885MAPK1 4010/4885KMT2A 2456/4885

“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.