SCHEMBL1966470

SCHEMBL1966470

CC(=O)N1C(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
GAA P10253 1/20 0.45
NOX1 Q9Y5S8 1/20 0.45
NR1H2 P55055 2/20 0.43
NR1H3 Q13133 2/20 0.43
CES1 P23141 2/20 0.42
NOTUM Q6P988 2/20 0.41
POLB P06746 4/20 0.40
KMT2A Q03164 1/20 0.40
KDM4A O75164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HK1 P19367 1/20 0.40
AGTR1 P30556 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
NQO2 P16083 1/20 0.40
CES2 O00748 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL4617586 0.80 CES1 (0.41) SMN1; SMN2MAPTGAANOX1NR1H2
SCHEMBL7519169 0.76 P2RX4 (0.45) SMN1; SMN2MAPTGAANR1H2NR1H3
SCHEMBL4742835 0.76 LMNA (0.47) SMN1; SMN2MAPTGAAPOLBKMT2A
Acetic Acid SCHEMBL27980670 0.76 GAA (0.50) SMN1; SMN2MAPTGAANR1H2NR1H3
SCHEMBL16706577 0.74 SMN1; SMN2 (0.59) SMN1; SMN2MAPTGAANOX1CES1
Biphenyl SCHEMBL29059196 0.73 SMN1; SMN2 (0.67) SMN1; SMN2MAPTGAACES1ALDH1A1
Biphenyl SCHEMBL15332958 0.73 SMN1; SMN2 (0.67) SMN1; SMN2MAPTGAACES1ALDH1A1
Biphenyl SCHEMBL538359 0.73 SMN1; SMN2 (0.67) SMN1; SMN2MAPTGAACES1ALDH1A1
Biphenyl SCHEMBL1822628 0.73 SMN1; SMN2 (0.67) SMN1; SMN2MAPTGAACES1ALDH1A1
SCHEMBL11409349 0.73 BCHE (0.53) SMN1; SMN2MAPTGAAKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101427135-B T cell assays ANTITOPE LTD. (GB) 2014-10-29 CN disclosed
EP-1989544-B1 T CELL ASSAYS ANTITOPE LTD (GB) 2011-06-22 EP disclosed
US-20090221024-A1 T CELL ASSAYS ANTITOPE LIMITED (GB) 2009-09-03 US disclosed
CN-101427135-A T cell assays ANTITOPE LTD (GB) 2009-05-06 CN disclosed
EP-1989544-A1 T CELL ASSAYS Antitope Limited (GB) 2008-11-12 EP disclosed
US-20080255091-A1 COMPOUNDS TO TREAT AMYLOIDOSIS AND PREVENT DEATH OF BETA-CELLS IN TYPE 2 DIABETES MELLITUS ASTRUM THERAPEUTICS PTY LTD. (AU) 2008-10-16 US disclosed
EP-1879564-A2 COMPOUNDS TO TREAT AMYLOIDOSIS AND PREVENT DEATH OF BETA-CELLS IN TYPE 2 DIABETES MELLITUS Astrum Therapeutics Pty, Ltd. (AU) 2008-01-23 EP disclosed
WO-2007099341-A1 T CELL ASSAYS ANTITOPE LIMITED (GB) 2007-09-07 WO disclosed
US-20060252819-A1 Compounds to treat amyloidosis and prevent death of beta-cells in type 2 diabetes mellitus ASTRUM THERAPEUTICS PTY LTD (AU) 2006-11-09 US disclosed
WO-2006110477-A2 COMPOUNDS TO TREAT AMYLOIDOSIS AND PREVENT DEATH OF BETA-CELLS IN TYPE 2 DIABETES MELLITUS ASTRUM THERAPEUTICS PTY. LTD. (AU) 2006-10-19 WO disclosed
WO-1997038978-A1 ANTICONVULSANT (10,11-DIHYDRO) 10-OXY-5H-DIBENZ[B,F]AZEPINE-5-CARBOXAMIDES TRIFARMA S.R.L. (IT) 1997-10-23 WO disclosed
US-4181655-A ANTIDEPRESSANTS RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY INC. (US) 1980-01-01 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-20080255091-A1 COMPOUNDS TO TREAT AMYLOIDOSIS AND PREVENT DEATH OF BETA-CELLS IN TYPE 2 DIABETES MELLITUS IAPP, BCL2, AMY2A SMN1; SMN2 387/4885MAPT 531/4885GAA 257/4885
US-20060252819-A1 Compounds to treat amyloidosis and prevent death of beta-cells in type 2 diabetes mellitus IAPP, BCL2, AMY2A SMN1; SMN2 387/4885MAPT 531/4885GAA 257/4885

“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.