SCHEMBL13401595

SCHEMBL13401595

CNC(=O)C(C)(C)N(C)C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ABCB1 P08183 2/20 0.43
LMNA P02545 1/20 0.43
CCR6 P51684 1/20 0.42
PAX8 Q06710 1/20 0.42
KMT2A Q03164 2/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40

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
SCHEMBL1285759 0.85 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL13397665 0.82 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL13300890 0.82 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL23944461 0.82 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL25901621 0.80 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL7694380 0.78 ALDH1A1 (0.62) ALDH1A1MAPTHPGDABCB1LMNA
SCHEMBL22326382 0.78 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL22780788 0.78 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MAPTHPGDABCB1
SCHEMBL13321683 0.76 AKT1 (0.47) ALDH1A1SMN1; SMN2MAPTHPGDLMNA
SCHEMBL26296065 0.75 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPTHPGDABCB1

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
WO-2023178299-A1 PRODRUGS OF GANAXOLONE MARINUS PHARMACEUTICALS, INC. (US) 2023-09-21 WO disclosed
US-8481683-B2 Human antibodies that bind CD22 and uses thereof MEDAREX, INC. (US) 2013-07-09 US disclosed
US-8461117-B2 Chemical linkers and cleavable substrates and conjugates thereof MEDAREX, INC. (US) 2013-06-11 US disclosed
US-8399403-B2 drug-ligand conjugates that are potent cytotoxins; stabilized therapeutic agents and markers; exhibit high specificity of action, reduced toxicity, and improved stability in blood ; antitumors MEDAREX, INC. (US) 2013-03-19 US disclosed
US-20100150950-A1 HUMAN ANTIBODIES THAT BIND CD70 AND USES THEREOF MEDAREX, INC. (US) 2010-06-17 US disclosed
US-20100145036-A1 CHEMICAL LINKERS AND CLEAVABLE SUBSTRATES AND CONJUGATES THEREOF MEDAREX, INC. (US) 2010-06-10 US disclosed
US-20100143368-A1 Human Antibodies That Bind Cd22 And Uses Thereof E. R. SQUIBB & SONS, L.L.C. 2010-06-10 US disclosed
US-20100092496-A1 CHEMICAL LINKERS AND CONJUGATES THEREOF MEDAREX, INC. (US) 2010-04-15 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-20100150950-A1 HUMAN ANTIBODIES THAT BIND CD70 AND USES THEREOF CD2BP2, CD74, CD63 ALDH1A1 3203/4885SMN1; SMN2 4036/4885MAPT 4512/4885
US-20100143368-A1 Human Antibodies That Bind Cd22 And Uses Thereof CD2BP2, CD22, CD2 ALDH1A1 1167/4885SMN1; SMN2 1542/4885MAPT 3906/4885
US-20100092496-A1 CHEMICAL LINKERS AND CONJUGATES THEREOF CLSPN, CD74, ANTXR2 ALDH1A1 2165/4885SMN1; SMN2 3628/4885MAPT 4080/4885
US-20100145036-A1 CHEMICAL LINKERS AND CLEAVABLE SUBSTRATES AND CONJUGATES THEREOF XIAP, ADAM8, CLSPN ALDH1A1 2684/4885SMN1; SMN2 2901/4885MAPT 4143/4885

“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.