SCHEMBL10174748

SCHEMBL10174748

CCc1c(C(=O)OC)cccc1N1CCCC(C(=O)OC)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
HSD17B10 Q99714 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPT P10636 3/20 0.41
TSHR P16473 2/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 8/20 0.41
LMNA P02545 1/20 0.41
CREBBP Q92793 1/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
USP2 O75604 1/20 0.39
THRB P10828 1/20 0.39
S100A4 P26447 1/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL10309775 0.86 GAA (0.45) KDM4EMAPTTSHRSMN1; SMN2ALDH1A1
SCHEMBL10174507 0.86 MAPT (0.44) KDM4EHSD17B10TDP1MAPTTSHR
SCHEMBL10309753 0.79 ALDH1A1 (0.52) KDM4EHSD17B10TDP1MAPTTSHR
SCHEMBL2070104 0.76 NOTUM (0.53) KDM4EHSD17B10TDP1MAPTTSHR
SCHEMBL2069693 0.76 GABRA1 (0.48) KDM4EHSD17B10TDP1MAPTTSHR
SCHEMBL10174679 0.76 ALDH1A1 (0.44) KDM4EHSD17B10TDP1MAPTTSHR
SCHEMBL10174567 0.75 ALDH1A1 (0.51) KDM4EMAPTPOLBSMN1; SMN2ALDH1A1
SCHEMBL28087158 0.72 NOTUM (0.56) HSD17B10MAPTTSHRPOLBSMN1; SMN2
SCHEMBL15630869 0.71 GAA (0.53) KDM4EHSD17B10MAPTPOLBSMN1; SMN2
SCHEMBL2069146 0.71 PTPN1 (0.56) KDM4EMAPTSMN1; SMN2ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1550662-B1 ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO (JP) 2012-07-04 EP disclosed
US-8148371-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-04-03 US disclosed
US-8148371-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-04-03 US disclosed
US-20100256118-A1 NOVEL ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO.,LTD. (JP) 2010-10-07 US disclosed
US-20100256118-A1 NOVEL ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO.,LTD. (JP) 2010-10-07 US disclosed
US-7754728-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-13 US disclosed
US-7754728-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-13 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-20100256118-A1 NOVEL ADENINE COMPOUND AND USE THEREOF ADORA1, P2RY10, HRH4 KDM4E 2210/4885HSD17B10 372/4885TDP1 3497/4885

“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.