SCHEMBL2866841

SCHEMBL2866841

O=C(/N=c1\sccn1-c1ccc(Cl)cc1)N1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 3/20 0.43
LMNA P02545 2/20 0.43
AKR1C3 P42330 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 4/20 0.42
NPC1 O15118 2/20 0.42
GFER P55789 1/20 0.39
HSD11B1 P28845 6/20 0.37
KMT2A Q03164 2/20 0.36
MALT1 Q9UDY8 1/20 0.36
POLB P06746 2/20 0.35
MAPT P10636 2/20 0.35

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
SCHEMBL2866846 1.00 SMN1; SMN2 (0.43) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL2868294 0.96 SMN1; SMN2 (0.40) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL2868292 0.96 SMN1; SMN2 (0.40) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL4235871 0.88 MALT1 (0.34) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL4235872 0.88 MALT1 (0.34) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL2866716 0.88 MAPT (0.39) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL2866718 0.88 MAPT (0.39) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1
SCHEMBL2871709 0.87 NPC1 (0.38) SMN1; SMN2HPGDLMNAALDH1A1HTT
SCHEMBL2871707 0.87 NPC1 (0.38) SMN1; SMN2HPGDLMNAALDH1A1HTT
SCHEMBL2858827 0.87 HPGD (0.41) SMN1; SMN2HPGDLMNAAKR1C3ALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2245020-B1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2014-01-15 EP claimed
US-8383657-B2 Thiazolylidine urea and amide derivatives and methods of use thereof ABBOTT LABORATORIES (US) 2013-02-26 US claimed
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-09-03 US claimed
US-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-06-25 US claimed
EP-2245020-B1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2014-01-15 EP disclosed
US-8383657-B2 Thiazolylidine urea and amide derivatives and methods of use thereof ABBOTT LABORATORIES (US) 2013-02-26 US disclosed
EP-2245020-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF Abbott Laboratories (US) 2010-11-03 EP disclosed
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-09-03 US disclosed
WO-2009086163-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-07-09 WO disclosed
WO-2009082698-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-07-02 WO disclosed
US-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-06-25 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 (2 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-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF NMUR1, NMUR2, PAM SMN1; SMN2 1424/4885HPGD 827/4885LMNA 2279/4885
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS CHRNA4, CHRNA5, CHRNA3 SMN1; SMN2 2490/4885HPGD 1323/4885LMNA 3760/4885

“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.