SCHEMBL2949765

SCHEMBL2949765

CN1CCN(C(=O)CCC(CSc2ccccc2)NC(=O)O)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.48
RAB9A P51151 6/20 0.48
ALDH1A1 P00352 6/20 0.48
NPC1 O15118 5/20 0.48
MAPT P10636 2/20 0.48
USP2 O75604 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
HPGD P15428 2/20 0.44
FKBP1A P62942 1/20 0.42
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.41
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
TSHR P16473 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
SCHEMBL2949763 1.00 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL14223693 0.89 SMN1; SMN2 (0.47) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL13503683 0.87 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL2947480 0.81 GAA (0.46) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL13504022 0.80 FKBP1A (0.45) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL13503545 0.78 HSD17B10 (0.45) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL18719831 0.77 SMN1; SMN2 (0.75) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL6790851 0.76 SMN1; SMN2 (0.43) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL6790854 0.76 SMN1; SMN2 (0.43) SMN1; SMN2RAB9AALDH1A1NPC1MAPT
SCHEMBL2943414 0.75 MTNR1A (0.47) ALDH1A1MTNR1AMTNR1B

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 7 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-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 1440/4885RAB9A 4211/4885ALDH1A1 2651/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 SMN1; SMN2 1656/4885RAB9A 3769/4885ALDH1A1 2460/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 SMN1; SMN2 1440/4885RAB9A 4211/4885ALDH1A1 2651/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR SMN1; SMN2 1713/4885RAB9A 3753/4885ALDH1A1 3404/4885

“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.