SCHEMBL5041890

SCHEMBL5041890

C=CC(=O)Nc1cc(OC)cc(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 5/20 0.69
KMT2A Q03164 4/20 0.56
POLB P06746 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 1/20 0.53
TP53 P04637 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
GAA P10253 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTT P42858 1/20 0.51
BTK Q06187 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
FGFR4 P22455 1/20 0.47
MAPT P10636 2/20 0.47

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
SCHEMBL1383792 0.83 TGM2 (0.66) TGM2KMT2APOLBSMN1; SMN2NPC1
SCHEMBL31069810 0.83 TGM2 (0.66) TGM2KMT2APOLBSMN1; SMN2NPC1
SCHEMBL782552 0.81 TGM2 (1.00) TGM2KMT2APOLBSMN1; SMN2NPC1
SCHEMBL24168839 0.81 MTNR1B (0.61) TGM2KMT2APOLBMEN1ALDH1A1
SCHEMBL30539172 0.81 MTNR1B (0.61) TGM2KMT2APOLBMEN1ALDH1A1
SCHEMBL16053417 0.80 TGM2 (0.64) TGM2
SCHEMBL30380385 0.79 TGM2 (0.49) TGM2KMT2APOLBSMN1; SMN2NPC1
SCHEMBL7826541 0.79 GAA (0.57) KMT2APOLBSMN1; SMN2NPC1RAB9A
SCHEMBL5509908 0.79 TGM2 (0.56) TGM2SMN1; SMN2ALDH1A1TP53CYP1A2
SCHEMBL28102497 0.79 TGM2 (0.56) TGM2CYP1A2CYP3A4CYP2D6CYP2C9

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
CN-116162039-B Synthesis method of visible light mediated butanediamide compound 河南师范大学 2025-02-07 CN disclosed
CN-116162039-A Synthesis method of visible light mediated butanediamide compound 河南师范大学 2023-05-26 CN disclosed
CN-106008480-A Quinazoline compound containing cinnamamide structure and preparation method and application thereof 江西科技师范大学 2016-10-12 CN disclosed
CN-100497355-C Hypophosphorous acid derivatives as beta-secretase inhibitors for the treatment of Alzheimer's disease HOFFMANN LA ROCHE (CH) 2009-06-10 CN disclosed
US-7345082-B2 Phosphinic acids HOFFMANN-LA ROCHE INC. (US) 2008-03-18 US disclosed
EP-1685142-B1 PHOSPHINIC ACID DERIVATIVES, BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE HOFFMANN LA ROCHE (CH) 2008-01-09 EP disclosed
CN-1878781-A Hypophosphorous acid derivatives as beta-secretase inhibitors for the treatment of Alzheimer's disease HOFFMANN LA ROCHE (CH) 2006-12-13 CN disclosed
EP-1685142-A1 PHOSPHINIC ACID DERIVATIVES, BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2006-08-02 EP disclosed
WO-2005044830-A1 PHOSPHINIC ACIDS DERIVATIVES, BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER’S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 WO disclosed
US-20050107341-A1 Phosphinic acids F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 US disclosed
US-4302484-A Polymers crosslinkable by electron beams BAYER AKTIENGESELLSCHAFT (DE) 1981-11-24 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-20050107341-A1 Phosphinic acids BACE1, PSEN1, PSEN2 TGM2 1013/4885KMT2A 2196/4885POLB 2621/4885

“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.