SCHEMBL2943599

SCHEMBL2943599

Cc1c(N2CCOCC2)sc2ccc(-c3ccc(C(=O)O)cc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.44
▸ EGLN1 Q9GZT9 1/20 0.41
▸ PIK3CA P42336 4/20 0.41
▸ PIK3CG P48736 2/20 0.41
▸ PIK3CD O00329 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ PIK3CB P42338 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ KMO O15229 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ CHRNA7 P36544 2/20 0.39
▸ CHEK1 O14757 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ PDE10A Q9Y233 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL2949116 0.88 PIK3CA (0.46) HSD17B10PIK3CAPIK3CGPIK3CDBRD4
SCHEMBL2949981 0.75 RAB9A (0.48) PIK3CAPIK3CDPIK3CBMAPK1MEN1
SCHEMBL2951733 0.72 RXRA (0.45) HSD17B10LMNAKDM4ERXRARXRB
SCHEMBL6374645 0.72 KMO (0.61) HSD17B10PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL24735751 0.72 KDM4E (0.49) HSD17B10LMNATSHRKDM4ETP53
SCHEMBL2947143 0.71 ERN1 (0.46) HSD17B10LMNAALDH1A1KDM4ERXRA
SCHEMBL2951760 0.70 RXRA (0.43) HSD17B10LMNAKDM4ERXRARXRB
SCHEMBL2950164 0.70 RXRA (0.43) HSD17B10LMNAKDM4ERXRARXRB
SCHEMBL60648 0.67 KMO (0.67) HSD17B10PIK3CAPIK3CGPIK3CDPIK3CB
SCHEMBL23259440 0.66 MAPT (0.54) HSD17B10PIK3CAPIK3CGPIK3CBLMNA

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 HSD17B10 923/4885EGLN1 371/4885PIK3CA 3954/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 HSD17B10 696/4885EGLN1 287/4885PIK3CA 3688/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 HSD17B10 923/4885EGLN1 371/4885PIK3CA 3954/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR HSD17B10 990/4885EGLN1 373/4885PIK3CA 3493/4885

“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.

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