SCHEMBL2950876

SCHEMBL2950876

CCOC(=O)c1ccc(N2CCN(C(=O)OCC(C)C)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.61
LMNA P02545 4/20 0.61
GAA P10253 3/20 0.61
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 7/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
HTT P42858 3/20 0.57
HPGD P15428 2/20 0.57
TSHR P16473 2/20 0.57
CASP1 P29466 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
MAPK1 P28482 2/20 0.53
RORC P51449 1/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
PLA2G1B P04054 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46

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
SCHEMBL8703730 0.91 MAPT (0.73) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL2951888 0.86 MAPT (0.55) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL22015905 0.84 HPGD (0.65) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL20188098 0.84 HPGD (0.65) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL5274074 0.83 MAPT (0.74) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL4116463 0.83 MAPT (0.69) MAPTLMNAGAAKDM4EALDH1A1
Hydrochloric Acid SCHEMBL10902446 0.82 MAPT (0.68) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL5266911 0.81 MAPT (0.53) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL24244944 0.81 MAPT (0.58) MAPTLMNAGAAKDM4EALDH1A1
SCHEMBL2723301 0.81 MAPT (0.58) MAPTLMNAGAAKDM4EALDH1A1

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 MAPT 4851/4885LMNA 472/4885GAA 2935/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 MAPT 4830/4885LMNA 456/4885GAA 3136/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 MAPT 4851/4885LMNA 472/4885GAA 2935/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR MAPT 4806/4885LMNA 329/4885GAA 2772/4885

“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.