SCHEMBL17549641

SCHEMBL17549641

CC(C)c1ccc(C(=O)CC(C(=O)O)N2CCN(C)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
POLB P06746 2/20 0.50
MAPT P10636 1/20 0.47
USP5 P45974 1/20 0.47
DRD3 P35462 1/20 0.44
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
HSP90AA1 P07900 1/20 0.43
MC4R P32245 1/20 0.43
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL17549636 0.83 HPGD (0.52) HSD17B10MAPTDRD3OPRK1HSP90AA1
SCHEMBL16415859 0.72 MAPT (0.50) HSD17B10POLBMAPTALDH1A1LMNA
SCHEMBL17549673 0.72 HSD17B10 (0.55) HSD17B10DRD3OPRD1HSP90AA1ALDH1A1
SCHEMBL27811710 0.71 HSD17B10 (0.73) HSD17B10MAPTDRD3HSP90AA1ALDH1A1
SCHEMBL17549634 0.70 HSD17B10 (0.52) HSD17B10MAPTHSP90AA1ALDH1A1LMNA
SCHEMBL104400 0.70 KMT2A (0.78) POLBALDH1A1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL6048626 0.70 HSD17B10 (0.71) HSD17B10MAPTDRD3HSP90AA1ALDH1A1
SCHEMBL14774780 0.70 MAPT (0.48) HSD17B10MAPTALDH1A1LMNA
SCHEMBL21834949 0.69 USP5 (0.59) POLBUSP5ALDH1A1LMNAMEN1
SCHEMBL15599303 0.69 HSD17B10 (1.00) HSD17B10POLBMAPTDRD3HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160060235-A1 Therapeutic Agent for Type 2 Diabetes NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY (JP) 2016-03-03 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-20160060235-A1 Therapeutic Agent for Type 2 Diabetes RNASE1, CDKL2, CDKL1 HSD17B10 3806/4885POLB 985/4885MAPT 3937/4885

“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.