SCHEMBL2947480

SCHEMBL2947480

CN1CCN(C[C@H](CSc2ccccc2)NC(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MTNR1A P48039 3/20 0.45
MTNR1B P49286 3/20 0.45
POLB P06746 1/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
GPR55 Q9Y2T6 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL2950945 0.86 FKBP1A (0.50) MTNR1AMTNR1BNPC1RAB9AL3MBTL1
SCHEMBL2949763 0.81 SMN1; SMN2 (0.48) MEN1KMT2AMTNR1AMTNR1BPOLB
SCHEMBL2949765 0.81 SMN1; SMN2 (0.48) MEN1KMT2AMTNR1AMTNR1BPOLB
Hydrochloric Acid SCHEMBL11590808 0.77 MAPT (0.59) GAAMEN1KMT2APOLBL3MBTL1
SCHEMBL21523434 0.76 HSD17B10 (0.54) KMT2ANPC1RAB9AMAPTKDM4E
SCHEMBL21523433 0.76 HSD17B10 (0.54) KMT2ANPC1RAB9AMAPTKDM4E
SCHEMBL6987077 0.75 GAA (0.49) GAAMEN1KMT2APOLBNPC1
SCHEMBL2942388 0.75 GAA (0.49) GAAMEN1KMT2APOLBNPC1
SCHEMBL13503964 0.75 MEN1 (0.43) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL22409436 0.74 BCL2L1 (0.38) MEN1KMT2AMTNR1AMTNR1BNPC1

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 GAA 2935/4885MEN1 4542/4885KMT2A 2902/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 GAA 3136/4885MEN1 4627/4885KMT2A 2895/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 GAA 2935/4885MEN1 4542/4885KMT2A 2902/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR GAA 2772/4885MEN1 4816/4885KMT2A 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.