SCHEMBL6002146

SCHEMBL6002146

CN1CCN(C2CCCc3cc(F)ccc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.45
HTR2C P28335 1/20 0.45
DRD3 P35462 1/20 0.45
RAD52 P43351 1/20 0.44
SRD5A1 P18405 3/20 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
SCHEMBL7684611 0.96 HTR1A (0.43) HTR1AHTR2CDRD3RAD52SRD5A1
SCHEMBL6001682 0.96 RAD52 (0.43) HTR1AHTR2CDRD3RAD52SRD5A1
SCHEMBL6002172 0.88 OPRM1 (0.51) HTR1AHTR2CDRD3RAD52
SCHEMBL6001612 0.82 DRD2 (0.49) HTR2CDRD3RAD52SRD5A1
SCHEMBL7684443 0.81 HTR2C (0.44) HTR2C
SCHEMBL6405877 0.81 DRD2 (0.44) HTR1AHTR2CDRD3
SCHEMBL7677541 0.79 CHRNA7 (0.42) SRD5A1
SCHEMBL6001969 0.78 CHRNA7 (0.68) HTR1AHTR2CDRD3
SCHEMBL28690252 0.78 HTR2C (0.47) HTR1AHTR2CDRD3
SCHEMBL29404649 0.78 HTR2C (0.47) HTR1AHTR2CDRD3

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
US-20060166984-A1 Amino substituted benzo(hetero)cyclic derivatives BASF AKTIENGESELLSCHAFT (DE) 2006-07-27 US disclosed
EP-1603395-A2 AMINO SUBSTITUTED BENZO(HETERO)CYCLIC DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2005-12-14 EP disclosed
WO-2004080170-A2 AMINO SUBSTITUTED BENZO(HETERO)CYCLIC DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2004-09-23 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-20060166984-A1 Amino substituted benzo(hetero)cyclic derivatives CBR3, L3MBTL3, BRS3 HTR1A 2209/4885HTR2C 792/4885DRD3 580/4885

“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.