Sugi Predict

Sugi Predict / Compounds / SCHEMBL9864028

SCHEMBL9864028

SCHEMBL9864028

CCCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ SLC6A5 Q9Y345 1/20 0.50
▸ MME P08473 2/20 0.49
▸ ACE P12821 1/20 0.49
▸ CPA1 P15085 1/20 0.49
▸ ACE2 Q9BYF1 1/20 0.49
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CTSD P07339 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
SCHEMBL5401 0.92 FAAH (0.59) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL2269347 0.92 FAAH (0.59) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL9651263 0.92 FAAH (0.59) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL27689822 0.87 FAAH (0.69) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL21585637 0.87 FAAH (0.69) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL21585636 0.87 FAAH (0.69) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL10723213 0.87 FAAH (0.69) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL10723219 0.87 FAAH (0.69) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL23203158 0.86 FAAH (0.72) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5
SCHEMBL20503297 0.86 FAAH (0.72) FAAHSMN1; SMN2ALDH1A1MAPTSLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240147997-A1 Herbicidal Compositions NUTRIEN AG SOLUTIONS (CANADA) INC (CA) 2024-05-09 — — US disclosed
WO-2017076998-A1 NOVEL CRYPTOPHYCIN COMPOUNDS AND CONJUGATES, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI (FR) 2017-05-11 — — WO disclosed
CN-1162077-C Aqueous liquid agricultural composition ������������ʽ���� 2004-08-18 — — CN disclosed
CN-1104195-C Adjuvant composition for agricutural chemicals and method for enhancing the efficacy of agricultural chemical KAO CORP (JP) 2003-04-02 — — CN disclosed
CN-1173110-A Adjuvant composition for agricutural chemicals and method for enhancing the efficacy of agricultural chemical KAO CROP (JP) 1998-02-11 — — CN disclosed
EP-0412906-A1 Pesticidal uses of bialaphos ROUSSEL-UCLAF (FR) 1991-02-13 — — EP disclosed
CN-87104564-A A kind of preparation method who contains the granular composition of agricultural chemical compound — 1988-02-03 — — CN 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-20240147997-A1 Herbicidal Compositions DDT, IDO1, IDO2 FAAH 229/4885SMN1; SMN2 4298/4885ALDH1A1 517/4885

“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.