SCHEMBL16768110

SCHEMBL16768110

C[C@@]1(C(=O)OCc2ccccc2)COCCN1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 4/20 0.40
USP2 O75604 1/20 0.39
GAA P10253 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
SCHEMBL2072649 0.88 ALDH1A1 (0.40) MEN1KMT2ANPSR1ALDH1A1USP2
SCHEMBL15573689 0.84 FKBP1A (0.41) MEN1KMT2ANPSR1ALDH1A1USP2
SCHEMBL16768111 0.77 DDB1 (0.40) MEN1KMT2ANPSR1ALDH1A1
SCHEMBL2072822 0.76 MEN1 (0.53) MEN1KMT2ANPSR1
SCHEMBL6132960 0.74 JAK2 (0.44) ALDH1A1GAA
SCHEMBL20599446 0.74 ALDH1A1 (0.46) MEN1KMT2ANPSR1ALDH1A1
SCHEMBL1256462 0.73 ALDH1A1 (0.51) MEN1KMT2ANPSR1ALDH1A1
SCHEMBL19124519 0.73 MEN1 (0.44) MEN1KMT2ANPSR1
SCHEMBL11301180 0.73 CYP3A4 (0.53) MEN1KMT2ANPSR1ALDH1A1GAA
SCHEMBL8473737 0.72 ALDH1A1 (0.47) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340538-B2 Dihydropyrimidine compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-05-17 US disclosed
US-9340538-B2 Dihydropyrimidine compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-05-17 US disclosed
US-20150152096-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-06-04 US disclosed
US-20150152096-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-06-04 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-20150152096-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS DPYD, SLC10A1, HPRT1 MEN1 1746/4885KMT2A 3244/4885NPSR1 3221/4885

“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.