SCHEMBL7045285

SCHEMBL7045285

O=C(O)C(=O)c1cc(Cl)sc1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.69
GSK3B P49841 1/20 0.57
HPGD P15428 3/20 0.47
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 2/20 0.47
RAB9A P51151 3/20 0.46
HTT P42858 2/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.44
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 1/20 0.35
HSP90AA1 P07900 1/20 0.35
OPRK1 P41145 1/20 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
SCHEMBL792551 0.82 DAO (1.00) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL11844863 0.79 DAO (0.71) DAOGSK3BHPGDMAPTL3MBTL1
Methane SCHEMBL7827704 0.78 DAO (0.62) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL377802 0.77 DAO (0.68) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL542159 0.76 DAO (0.65) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL17103510 0.76 DAO (0.65) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL15988630 0.74 GSK3B (0.74) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL6790563 0.72 GSK3B (1.00) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL9591168 0.72 DAO (0.61) DAOGSK3BHPGDMAPTL3MBTL1
SCHEMBL2063137 0.72 DAO (0.61) DAOGSK3BHPGDMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN claimed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO claimed
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN disclosed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO disclosed
US-6613786-B2 Treating urinary incontinence, asthma, irritable bowel syndrome or male erectile dysfunction BRISTOL-MYERS SQUIBB COMPANY 2003-09-02 US disclosed
US-20030144333-A1 Thiophenyl triazol-3-one derivatives as smooth muscle relaxants HEWAWASAM PIYASENA (US) 2003-07-31 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-20030144333-A1 Thiophenyl triazol-3-one derivatives as smooth muscle relaxants PDE3A, ADRB2, ADRB3 DAO 3738/4885GSK3B 3398/4885HPGD 1329/4885

“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.