SCHEMBL2949256

SCHEMBL2949256

CC1(O)CC=C(c2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.42
RARG P13631 8/20 0.42
RARA P10276 7/20 0.42
RXRA P19793 9/20 0.40
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
RXRB P28702 4/20 0.39
RXRG P48443 2/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL2949539 0.83 NPC1 (0.43) MAPTTSHR
SCHEMBL743512 0.75 IKBKE (0.48) RARBRARGRARARXRARXRB
SCHEMBL19876977 0.73 TSHR (0.55) RXRARXRBRXRGTP53TSHR
SCHEMBL13185358 0.72 TSHR (0.38) TSHR
SCHEMBL3751478 0.68 ACMSD (0.60) RXRARXRBRXRGTP53TSHR
SCHEMBL6069021 0.67 ACMSD (0.61) RXRARXRBRXRGTP53TSHR
SCHEMBL21410003 0.66 TSHR (0.40) RXRARXRBRXRGTP53TSHR
SCHEMBL28446430 0.65 TSHR (0.71) RXRARXRBRXRGTP53TSHR
SCHEMBL2637326 0.65 TSHR (0.80) RXRARXRBRXRGTP53TSHR
SCHEMBL69873 0.65 TSHR (0.80) RXRARXRBRXRGTP53TSHR

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 10 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
EP-1318978-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2003-06-18 EP 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
WO-2002024636-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2002-03-28 WO 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 RARB 3309/4885RARG 4026/4885RARA 4032/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 RARB 3133/4885RARG 3990/4885RARA 4039/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 RARB 3309/4885RARG 4026/4885RARA 4032/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR RARB 2464/4885RARG 3388/4885RARA 3640/4885

“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.