SCHEMBL6474401

SCHEMBL6474401

O=C1C2CC=CCC2C(=O)N1CCCN1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.60
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
MAPK1 P28482 1/20 0.59
HTR1A P08908 3/20 0.54
GRIN1 Q05586 1/20 0.52
GRIN2B Q13224 1/20 0.52
HTR2A P28223 2/20 0.51
DRD2 P14416 1/20 0.51

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
Hydrochloric Acid SCHEMBL7613022 0.99 HTR7 (0.59) HTR7KDM4ELMNAMAPK1HTR1A
SCHEMBL6475395 0.87 HTR1A (0.67) HTR7LMNAHTR1AHTR2ADRD2
Hydrochloric Acid SCHEMBL7606820 0.86 HTR1A (0.65) HTR7LMNAMAPK1HTR1AHTR2A
SCHEMBL6474706 0.84 HTR7 (0.60) HTR7KDM4ELMNAMAPK1HTR1A
Hydrochloric Acid SCHEMBL7099309 0.83 HTR7 (0.59) HTR7KDM4ELMNAMAPK1HTR1A
SCHEMBL6482761 0.83 ADRA1B (0.55) HTR7KDM4ELMNAMAPK1HTR1A
SCHEMBL6474379 0.83 MAPT (0.64) HTR7HTR1AHTR2ADRD2
Hydrochloric Acid SCHEMBL7103130 0.82 ADRA1B (0.56) HTR7KDM4ELMNAMAPK1HTR1A
Hydrochloric Acid SCHEMBL7605817 0.82 MAPT (0.63) HTR7HTR1AHTR2ADRD2
SCHEMBL6474033 0.81 HTR7 (0.60) HTR7KDM4EHTR1AHTR2ADRD2

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-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2002-10-24 US claimed
US-6914064-B2 1,4-Disubstituted piperazine derivatives useful as uro-selective α1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2005-07-05 US disclosed
US-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2002-10-24 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-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers ADRB1, ADRB2, ADRA1B HTR7 426/4885KDM4E 3522/4885LMNA 3477/4885

“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.