SCHEMBL5923751

SCHEMBL5923751

CCCC(=O)Nc1cc(C2CCN(CCCN(C(=O)Cc3ccccc3)C(=O)Cc3ccccc3)CC2)ccc1F

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HDAC1 Q13547 1/20 0.44
UBE2M P61081 9/20 0.43
DCUN1D1 Q96GG9 9/20 0.43
OPRM1 P35372 2/20 0.40
CCR3 P51677 1/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL5923658 0.87 DRD2 (0.48) DRD2CCR3
SCHEMBL5923589 0.85 UBE2M (0.49) DRD2UBE2MDCUN1D1
SCHEMBL4769696 0.84 CYP3A4 (0.50) DRD2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL5923753 0.78 ADRA1D (0.58)
SCHEMBL5923679 0.78 DRD2 (0.44) DRD2
SCHEMBL5923701 0.77 DRD4 (0.45) DRD2HDAC1UBE2MDCUN1D1RAB9A
SCHEMBL5923750 0.75 DRD2 (0.56) DRD2
SCHEMBL5508600 0.75 DRD2 (0.56) DRD2
SCHEMBL4768518 0.74 DRD2 (0.47) DRD2
SCHEMBL5521956 0.74 DRD2 (0.53) DRD2

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-20060041139-A9 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. LUNDBECK A/S (DK) 2006-02-23 US disclosed
US-20040073036-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-15 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-20040073036-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R DRD2 74/4885CYP3A4 2068/4885CYP2D6 1637/4885
US-20060041139-A9 SUBSTITUTED ALKYL AMIDO PIPERIDINES MCHR1, MCHR2, MC1R DRD2 74/4885CYP3A4 2068/4885CYP2D6 1637/4885

“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.