SCHEMBL16769743

SCHEMBL16769743

CC(=O)C1CCN(c2ccc(OC(C)C)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.48
LCAT P04180 3/20 0.47
ACACB O00763 6/20 0.46
GPR119 Q8TDV5 4/20 0.45
LRRK2 Q5S007 1/20 0.45
KDM4E B2RXH2 1/20 0.43
ABL1 P00519 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL16769742 0.89 LCAT (0.47) HRH3LCATACACBGPR119KDM4E
SCHEMBL16648490 0.84 USP30 (0.52) GPR119KDM4E
SCHEMBL1245496 0.84 LRRK2 (0.54) HRH3LCATACACBGPR119LRRK2
SCHEMBL16769757 0.81 CHRM4 (0.55) HRH3LCATACACBKDM4EABL1
SCHEMBL16769751 0.80 ACACB (0.49) HRH3LCATACACBKDM4EABL1
SCHEMBL20152892 0.78 HRH3 (0.53) HRH3LCATGPR119KDM4EABL1
SCHEMBL16769734 0.78 HRH3 (0.48) HRH3LCATACACBKDM4ELMNA
SCHEMBL16769732 0.77 GPR119 (0.53) GPR119KDM4EABL1LMNA
SCHEMBL16769733 0.77 HRH3 (0.55) HRH3GPR119KDM4EABL1LMNA
SCHEMBL16769756 0.75 LMNA (0.46) HRH3LCATGPR119KDM4EABL1

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-9796709-B2 5-hydroxy-4-(trifluoromethyl)pyrazolopyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-24 US disclosed
US-20160376267-A1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-12-29 US disclosed
US-9150575-B2 Piperidinylpyrazolopyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-10-06 US disclosed
US-20150152102-A1 PIPERIDINYLPYRAZOLOPYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 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 (2 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-20160376267-A1 5-HYDROXY-4-(TRIFLUOROMETHYL)PYRAZOLOPYRIDINE DERIVATIVE LDLR, LCAT, LPL HRH3 943/4885LCAT 2/4885ACACB 435/4885
US-20150152102-A1 PIPERIDINYLPYRAZOLOPYRIDINE DERIVATIVE LCAT, LPL, LCLAT1 HRH3 3681/4885LCAT 1/4885ACACB 209/4885

“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.