SCHEMBL4558419

SCHEMBL4558419

CCCCCN1CCN(CCCCCC(=O)NC2CCCc3ccccc32)CC1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.79
HTR1A P08908 12/20 0.79
HTR7 P34969 5/20 0.76
MEN1 O00255 1/20 0.72
MTOR P42345 1/20 0.72
RAB9A P51151 1/20 0.72
KMT2A Q03164 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
ADRB2 P07550 1/20 0.71
ADRA2A P08913 1/20 0.71
GPR65 Q8IYL9 1/20 0.71

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
SCHEMBL14335327 0.91 MEN1 (0.69) DRD2HTR1AHTR7MEN1KMT2A
SCHEMBL14336032 0.91 MEN1 (0.69) DRD2HTR1AHTR7MEN1KMT2A
SCHEMBL14376708 0.91 MEN1 (0.69) DRD2HTR1AHTR7MEN1KMT2A
SCHEMBL14376821 0.91 MEN1 (0.69) DRD2HTR1AHTR7MEN1KMT2A
SCHEMBL3330158 0.87 MEN1 (0.71) DRD2HTR1AMEN1KMT2A
SCHEMBL4464192 0.86 DRD2 (1.00) DRD2HTR1AHTR7MEN1MTOR
SCHEMBL4460956 0.85 DRD2 (1.00) DRD2HTR1AHTR7MEN1MTOR
SCHEMBL4462276 0.85 DRD2 (1.00) DRD2HTR1AHTR7MEN1MTOR
SCHEMBL7003255 0.84 CA12 (0.65) DRD2HTR1AHTR7MEN1KMT2A
SCHEMBL4458829 0.84 DRD2 (1.00) DRD2HTR1AHTR7

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
WO-2023172701-A2 THERAPEUTIC COMBINATIONS, COMPOSITIONS, AND METHODS FOR DESIGNING AND PRODUCING ENTACTOGENIC MINDSTATES MINDSTATE DESIGN LABS, INC. (US) 2023-09-14 WO disclosed
US-7488730-B2 N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4-phenyl-1-piperazinealkylamide derivatives, and therapeutic use thereof as 5-HT7 receptor ligands UNIVERSITA DEGLI STUDI DI BARI (IT) 2009-02-10 US disclosed
US-20070117811-A1 N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4-phenyl-1-piperazinealkylamide derivatives, and therapeutic use thereof as 5-HT7 receptor ligands UNIVERSITA DEGLI STUDI DI BARI (IT) 2007-05-24 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-20070117811-A1 N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4-phenyl-1-piperazinealkylamide derivatives, and therapeutic use thereof as 5-HT7 receptor ligands HTR7, HTR3A, HTR1E DRD2 187/4885HTR1A 5/4885HTR7 1/4885

“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.