SCHEMBL4848028

SCHEMBL4848028

Cc1ncc(N)cc1C1CCN(Cc2ccc(Oc3ccc(F)c(F)c3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.54
ADRA1A P35348 3/20 0.54
KCNH2 Q12809 1/20 0.45
MCHR1 Q99705 1/20 0.45
OPRM1 P35372 1/20 0.41
ALDH1A1 P00352 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
DRD4 P21917 3/20 0.38
SIGMAR1 Q99720 3/20 0.38
AXL P30530 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36

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
SCHEMBL4848389 0.89 DRD2 (0.43) DRD2ADRA1AOPRM1CCNT1CDK9
SCHEMBL4850559 0.85 DRD2 (0.66) DRD2ADRA1AKCNH2MCHR1OPRM1
SCHEMBL4854854 0.81 DRD2 (0.61) DRD2ADRA1AKCNH2MCHR1OPRM1
SCHEMBL4854417 0.81 DRD2 (0.53) DRD2ADRA1AKCNH2MCHR1ALDH1A1
SCHEMBL4850462 0.79 DRD2 (0.54) DRD2ADRA1AKCNH2MCHR1OPRM1
SCHEMBL4856874 0.76 DRD2 (0.52) DRD2ADRA1AKCNH2MCHR1ALDH1A1
SCHEMBL4852804 0.74 DRD2 (0.53) DRD2ADRA1AOPRM1ALDH1A1
SCHEMBL4854358 0.70 DRD2 (0.42) DRD2ADRA1AOPRM1
SCHEMBL4856693 0.70 DRD2 (0.49) DRD2ADRA1AOPRM1ALDH1A1JAK2
SCHEMBL5660385 0.70 DRD2 (1.00) DRD2ADRA1A

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-7446204-B2 Amino substituted aryloxybenzylpiperidine derivatives H. LUNDBECK A/S (DK) 2008-11-04 US disclosed
EP-1804796-A2 AMINO SUBSTITUTED ARYLOXYBENZYLPIPERIDINE DERIVATIVES H.Lundbeck A/S (DK) 2007-07-11 EP disclosed
WO-2006041636-A2 AMINO SUBSTITUTED ARYLOXYBENZYLPIPERIDINE DERIVATIVES H.LUNDBECK A/S (DK) 2006-04-20 WO disclosed
US-20060079524-A1 Amino substituted aryloxybenzylpiperidine derivatives H. LUNDBECK A/S 2006-04-13 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-20060079524-A1 Amino substituted aryloxybenzylpiperidine derivatives MCHR1, MCHR2, MC4R DRD2 198/4885ADRA1A 34/4885KCNH2 2915/4885

“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.