SCHEMBL4849548

SCHEMBL4849548

CC(C)(C)CN(CC1(c2cccc(C(F)(F)F)c2)CCN(Cc2ccccc2)CC1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.51
CHRM4 P08173 1/20 0.48
DRD4 P21917 1/20 0.46
USP2 O75604 1/20 0.46
OPRM1 P35372 3/20 0.45
UBE2M P61081 2/20 0.45
DCUN1D1 Q96GG9 2/20 0.45
SIGMAR1 Q99720 1/20 0.45
SLC6A4 P31645 3/20 0.44
TACR1 P25103 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
FAAH O00519 1/20 0.43
CCR2 P41597 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
SCHEMBL4855793 0.87 OPRL1 (0.53) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL2808174 0.86 OPRL1 (0.54) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL4848483 0.85 SLC6A4 (0.44) OPRL1CHRM4OPRM1SLC6A4TACR1
SCHEMBL4849540 0.82 OPRL1 (0.50) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL4848253 0.82 CCR2 (0.50) OPRL1OPRM1SLC6A4TACR1SLC6A2
SCHEMBL4852933 0.81 MAPT (0.47) TACR1LMNAHTTKDM4EALDH1A1
SCHEMBL2834684 0.80 OPRL1 (0.54) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL699951 0.79 OPRL1 (0.63) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL2808153 0.78 CHRM4 (0.57) OPRL1CHRM4DRD4USP2OPRM1
SCHEMBL2808157 0.78 OPRL1 (0.56) OPRL1CHRM4DRD4USP2OPRM1

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-7423039-B2 (4-phenylpiperazin-1-yl)acylpiperidine derivatives, preparation thereof and application of same in therapeutics SANOFI-AVENTIS (FR) 2008-09-09 US disclosed
US-20070021609-A1 4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2007-01-25 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-20070021609-A1 4-PHENYLPIPERAZIN-1-YL)ACYLPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND APPLICATION OF SAME IN THERAPEUTICS AGPAT5, DNPEP, AGPAT2 OPRL1 2532/4885CHRM4 2925/4885DRD4 3543/4885

“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.