SCHEMBL6995548

SCHEMBL6995548

O=C1NCC2CCC1N2Cc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
DRD2 P14416 4/20 0.41
DRD4 P21917 4/20 0.41
DRD3 P35462 3/20 0.41
SIGMAR1 Q99720 1/20 0.40
SLC6A2 P23975 1/20 0.37
HCRTR2 O43614 1/20 0.36
LTA4H P09960 1/20 0.36
MAPT P10636 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
SCHEMBL928600 0.85 SIGMAR1 (0.47) ALDH1A1SIGMAR1
SCHEMBL6774733 0.85 SIGMAR1 (0.47) ALDH1A1SIGMAR1
SCHEMBL7003184 0.77 DRD2 (0.51) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL6153609 0.72 DRD2 (0.50) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL13986863 0.72 SIGMAR1 (0.36) ALDH1A1SIGMAR1
SCHEMBL5971566 0.70 DRD2 (0.54) DRD2DRD4DRD3SIGMAR1SLC6A2
SCHEMBL10816114 0.67 OPRK1 (0.49) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL6153361 0.66 DRD2 (0.54) DRD2DRD4DRD3SLC6A2LTA4H
SCHEMBL30833222 0.66 DRD2 (0.51) DRD2DRD4DRD3SLC6A2LTA4H
SCHEMBL3880873 0.66 DRD2 (0.51) DRD2DRD4DRD3SLC6A2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326867-A2 BRIDGED PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-07-16 EP disclosed
US-20020119961-A1 Bridged piperazine derivatives PFIZER INC. 2002-08-29 US disclosed
WO-2002032901-A2 BRIDGED PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-04-25 WO 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-20020119961-A1 Bridged piperazine derivatives MYD88, IL4, ARG1 ALDH1A1 772/4885POLB 3658/4885DRD2 289/4885

“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.