SCHEMBL16769745

SCHEMBL16769745

CC(=O)C1CCN(c2ccc(OC(F)F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.53
CHRM4 P08173 1/20 0.50
FFAR4 Q5NUL3 1/20 0.43
LCAT P04180 1/20 0.43
MAPT P10636 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
HSP90AA1 P07900 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
HTT P42858 1/20 0.42
CCR6 P51684 1/20 0.42
ATM Q13315 1/20 0.42
RORC P51449 1/20 0.42
NOTUM Q6P988 1/20 0.41
TSHR P16473 1/20 0.41
MDM2 Q00987 1/20 0.41
GAA P10253 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
SCHEMBL31381181 0.87 FFAR4 (0.55) ACACBCHRM4FFAR4LCATMEN1
SCHEMBL16649043 0.83 MAPT (0.61) CHRM4MAPTMEN1KMT2AALDH1A1
SCHEMBL16769744 0.80 LCAT (0.47) ACACBCHRM4LCAT
SCHEMBL16769742 0.80 LCAT (0.47) ACACBLCATMEN1KMT2AALDH1A1
SCHEMBL16769747 0.80 CHRM4 (0.58) CHRM4FFAR4NOTUM
SCHEMBL8257274 0.79 GFER (0.58) ACACBMAPTMEN1KMT2AALDH1A1
SCHEMBL16769748 0.78 MAPT (0.52) ACACBMAPTMEN1KMT2AALDH1A1
SCHEMBL21097704 0.77 GPR119 (0.51) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL3859545 0.76 HRH3 (0.63) ACACBCHRM4MAPTMEN1KMT2A
SCHEMBL20841042 0.76 MAPT (0.48) ACACBMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20150152102-A1 PIPERIDINYLPYRAZOLOPYRIDINE DERIVATIVE LCAT, LPL, LCLAT1 ACACB 209/4885CHRM4 4550/4885FFAR4 497/4885

“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.