SCHEMBL5896844

SCHEMBL5896844

COC(=O)C1CCC(c2ccccc2C)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
GAA P10253 2/20 0.40
TSHR P16473 1/20 0.40
HPGD P15428 4/20 0.39
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 2/20 0.36
USP2 O75604 1/20 0.36
THRB P10828 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALOX15 P16050 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL512937 0.84 PKM (0.51) GAATSHRHPGDMEN1KMT2A
SCHEMBL5897596 0.80 POLB (0.45) TSHRPOLBKDM4EL3MBTL1
SCHEMBL5489867 0.73 TP53 (0.45) GAATSHRHPGDMEN1KMT2A
SCHEMBL28437957 0.73 FKBP1A (0.42) DDB1CRBNGAATSHRMAPT
SCHEMBL13882832 0.73 CYP1A2 (0.46) HPGDKMT2AALDH1A1SMN1; SMN2
SCHEMBL7027734 0.72 TP53 (0.44) GAATSHRHPGDMEN1KMT2A
SCHEMBL5493022 0.72 ALDH1A1 (0.48) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL512832 0.72 SMN1; SMN2 (0.46) GAATSHRHPGDMAPTMEN1
SCHEMBL512462 0.72 TSHR (0.50) GAATSHRMAPTMEN1KMT2A
SCHEMBL5896818 0.72 GPBAR1 (0.48)

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 DDB1 4263/4885CRBN 1642/4885GAA 3298/4885

“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.