SCHEMBL5897594

SCHEMBL5897594

COC(=O)C1CCC(c2ccc(OC)cc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.46
MMP13 P45452 1/20 0.46
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.41
BACE1 P56817 1/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL5896818 0.85 GPBAR1 (0.48) SLC6A2SLC6A4SLC6A3TP53
SCHEMBL5897596 0.84 POLB (0.45) SLC6A2SLC6A4SLC6A3ATML3MBTL1
SCHEMBL5896882 0.84 CRBN (0.51) CRBNKDM4ESMN1; SMN2
SCHEMBL5493022 0.79 ALDH1A1 (0.48) KDM4EALDH1A1MAPK1ALOX15SMN1; SMN2
SCHEMBL5897010 0.78 POLB (0.46) KDM4EALDH1A1PKMSMN1; SMN2
SCHEMBL4059047 0.76 TP53 (0.49) SLC6A2SLC6A4SLC6A3ATML3MBTL1
SCHEMBL4136122 0.76 TP53 (0.52) SLC6A2SLC6A4SLC6A3ATML3MBTL1
SCHEMBL13882832 0.74 CYP1A2 (0.46) ATMALDH1A1TP53SMN1; SMN2
SCHEMBL512937 0.74 PKM (0.51) L3MBTL1KDM4EALDH1A1TP53PKM
SCHEMBL5896844 0.72 DDB1 (0.42) DDB1CRBNL3MBTL1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7038087-B2 Process for the production of optically active amino alcohols TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-05-02 US disclosed
US-20040063999-A1 Process for the production of optically active amino alcohols TAKASAGO INTERNATIONAL CORPORATION (JP) 2004-04-01 US disclosed
EP-1398310-A1 Process for the production of optically active amino alcohols Takasago International Corporation (JP) 2004-03-17 EP 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-20040063999-A1 Process for the production of optically active amino alcohols ADH1C, ADH1A, ADH5 MMP1 3294/4885MMP13 3429/4885DDB1 4263/4885

“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.