SCHEMBL2952091

SCHEMBL2952091

CN(C(=O)O)C12CCC(CNc3ccc(S(N)(=O)=O)cc3[N+](=O)[O-])(CC1)CC2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 13/20 0.50
PKM P14618 4/20 0.50
POLB P06746 2/20 0.50
GAA P10253 5/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
LMNA P02545 3/20 0.44
DOT1L Q8TEK3 1/20 0.43
ALDH1A1 P00352 2/20 0.42
BCL2L1 Q07817 1/20 0.42
HTT P42858 1/20 0.42
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCL1 Q07820 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
SCHEMBL2946907 0.84 MAPT (0.52) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL6794026 0.83 SMN1; SMN2 (0.48) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL2943266 0.81 BCL2L1 (0.59) BCL2L1MCL1
SCHEMBL6794022 0.78 MAPT (0.46) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL2951573 0.77 BCL2L1 (0.56) BCL2L1
SCHEMBL2481803 0.75 MAPT (0.54) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL1956245 0.75 SMN1; SMN2 (0.56) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL2388189 0.74 MAPT (0.55) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL28526212 0.73 MAPT (0.54) SMN1; SMN2MAPTPKMPOLBGAA
SCHEMBL16037529 0.73 MAPT (0.59) SMN1; SMN2MAPTPKMPOLBGAA

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR SMN1; SMN2 1713/4885MAPT 4806/4885PKM 4415/4885

“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.