SCHEMBL5997107

SCHEMBL5997107

CCOC(=O)C(CN1C(=O)c2cccc(C)c2C1=O)C1(C)OCCO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 4/20 0.37
PABPC1 P11940 2/20 0.37
PIN1 Q13526 1/20 0.36
PIN4 Q9Y237 1/20 0.36
MEN1 O00255 3/20 0.36
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
AVPR1A P37288 1/20 0.35
POLB P06746 1/20 0.35
APAF1 O14727 1/20 0.34
MITF O75030 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TYMS P04818 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL5997961 0.92 ANPEP (0.38) ALDH1A1MAPTHSD17B10HTTKMT2A
SCHEMBL5998133 0.91 KMT2A (0.37) ALDH1A1MAPTHSD17B10HTTKMT2A
SCHEMBL5996055 0.91 HPGD (0.37) ALDH1A1MAPTHSD17B10HTTKMT2A
SCHEMBL5998754 0.87 MAPT (0.46) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL5997292 0.85 ALDH1A1 (0.43) ALDH1A1KMT2APIN1PIN4MEN1
SCHEMBL5996174 0.83 PIN1 (0.33) ALDH1A1MAPTHTTKMT2APIN1
SCHEMBL5996858 0.83 PIN1 (0.36) ALDH1A1MAPTHSD17B10HTTKMT2A
SCHEMBL5998689 0.82 TNF (0.38) ALDH1A1MAPTKMT2APABPC1MEN1
SCHEMBL5997985 0.81 ALDH1A1 (0.40) ALDH1A1MAPTKMT2APIN1PIN4
SCHEMBL5998695 0.81 PIN1 (0.36) ALDH1A1MAPTHSD17B10HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7094908-B2 Reduction of carbonyl compounds using the carbonyl reductase of Kluyveromyces marxianus KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2006-08-22 US disclosed
US-20030139464-A1 Reduction of carbonyl compounds using the carbonyl reductase of kluyveromyces marxianus KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY 2003-07-24 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-20030139464-A1 Reduction of carbonyl compounds using the carbonyl reductase of kluyveromyces marxianus CBR1, CBR3, DCXR ALDH1A1 216/4885MAPT 3262/4885HSD17B10 73/4885

“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.