SCHEMBL6602182

SCHEMBL6602182

CC1(c2cccc(-c3ncc[nH]3)c2)CCN(Cc2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
DRD4 P21917 2/20 0.45
DRD3 P35462 2/20 0.45
MTOR P42345 1/20 0.43
ADK P55263 1/20 0.43
NISCH Q9Y2I1 1/20 0.43
OPRL1 P41146 1/20 0.42
POLB P06746 1/20 0.41
CHRNA7 P36544 1/20 0.41
OPRM1 P35372 1/20 0.40
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
HIF1A Q16665 1/20 0.39
CYP3A4 P08684 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
SCHEMBL6607339 0.81 DRD3 (0.42) DRD3OPRM1CYP2C9CYP2C19CYP3A4
SCHEMBL6605765 0.78 DRD2 (0.47) DRD2DRD4DRD3OPRL1POLB
SCHEMBL6603218 0.78 DRD2 (0.47) DRD2DRD4DRD3MTOROPRL1
SCHEMBL3252230 0.75 OPRL1 (0.65) DRD2MTOROPRL1POLBOPRM1
Hydrochloric Acid SCHEMBL6160179 0.74 POLB (0.66) DRD2DRD4DRD3MTOROPRL1
SCHEMBL27550808 0.74 OPRL1 (0.63) DRD2DRD4DRD3MTOROPRL1
SCHEMBL6601990 0.74 DRD2 (0.45) DRD2DRD4DRD3OPRL1POLB
SCHEMBL6601752 0.74 OPRD1 (0.62) DRD2DRD3OPRL1POLBOPRM1
SCHEMBL12879381 0.72 DRD2 (0.49) DRD2DRD4DRD3OPRL1POLB
SCHEMBL6600993 0.71 OPRM1 (0.56) DRD2DRD4DRD3OPRL1POLB

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
EP-1072601-B1 4-arylpiperidine derivatives for the treatment of pruritus PFIZER (US) 2004-09-08 EP disclosed
US-6750231-B2 SKIN DISORDERS; GASTROINTESTINAL DISORDERS PFIZER INC 2004-06-15 US disclosed
US-20030004340-A1 New 4-arylpiperidine derivatives for the treatment of pruritus GIBSON STEPHEN PAUL (GB) 2003-01-02 US disclosed
EP-1072601-A2 4-arylpiperidine derivatives for the treatment of pruritus PFIZER INC. (US) 2001-01-31 EP 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-20030004340-A1 New 4-arylpiperidine derivatives for the treatment of pruritus HRH2, HRH4, HRH1 DRD2 148/4885DRD4 237/4885DRD3 136/4885

“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.