SCHEMBL5069182

SCHEMBL5069182

CC(C)Cn1cc(C(=O)O)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 0.64
KAT2B Q92831 1/20 0.59
ALDH1A1 P00352 3/20 0.57
MAPT P10636 1/20 0.53
KMT2A Q03164 2/20 0.51
LMNA P02545 1/20 0.51
CREBBP Q92793 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL17885845 0.86 ALDH1A1 (0.72) PLK1KAT2BALDH1A1KMT2ALMNA
SCHEMBL1127285 0.85 PLK1 (0.57) PLK1KAT2BALDH1A1MAPTKMT2A
SCHEMBL15971141 0.84 NR4A2 (0.72) KAT2BALDH1A1MAPTKMT2ALMNA
SCHEMBL3043520 0.82 PLK1 (0.62) PLK1KAT2BALDH1A1MAPTKMT2A
SCHEMBL2429622 0.82 NR4A2 (0.69) PLK1ALDH1A1MAPTKMT2ALMNA
SCHEMBL30373303 0.82 NR4A2 (0.69) PLK1ALDH1A1MAPTKMT2ALMNA
SCHEMBL4035309 0.81 ICMT (0.51) PLK1KAT2BALDH1A1MAPTKMT2A
SCHEMBL3596003 0.80 ICMT (0.46) PLK1KMT2A
SCHEMBL2644030 0.80 CPT1A (0.44) PLK1KAT2BMAPT
SCHEMBL5066705 0.79 ALDH1A1 (0.58) PLK1ALDH1A1MAPTKMT2ALMNA

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
EP-1595866-B1 Cyanopyrrolidines useful for the treatment of inter alia metabolic syndrome SANWA KAGAKU KENKYUSHO CO (JP) 2016-06-08 EP disclosed
CN-100434420-C Compounds that block dipeptidyl peptidase IV SANWA KAGAKU KENKYUSHO CO (JP) 2008-11-19 CN disclosed
US-7345180-B2 Compound inhibiting dipeptidyl peptidase IV SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2008-03-18 US disclosed
US-20060229286-A1 Compound inhibiting dipeptidyl peptidase IV SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2006-10-12 US disclosed
CN-1745063-A Compound inhibiting dipeptidyl peptidase iv SANWA KAGAKU KENKYUSHO CO (JP) 2006-03-08 CN disclosed
EP-1595866-A1 COMPOUND INHIBITING DIPEPTIDYL PEPTIDASE IV Sanwa Kagaku Kenkyusho Co., Ltd. (JP) 2005-11-16 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-20060229286-A1 Compound inhibiting dipeptidyl peptidase IV DPP4, DPP3, DPP7 PLK1 4524/4885KAT2B 2401/4885ALDH1A1 2457/4885

“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.