SCHEMBL5390865

SCHEMBL5390865

CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C1CN(C(=O)OC(C)(C)C)CCN1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.50
CCR1 P32246 6/20 0.43
CNR1 P21554 1/20 0.41
GPR119 Q8TDV5 3/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
BIRC5 O15392 1/20 0.40
MAPT P10636 1/20 0.40
STS P08842 1/20 0.39
MC4R P32245 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CETP P11597 1/20 0.38

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
SCHEMBL5395886 0.91 TACR1 (0.43) TACR1CCR1CNR1GPR119JAK2
SCHEMBL6261284 0.88 CCR1 (0.46) TACR1CCR1CNR1
SCHEMBL5409066 0.84 TACR1 (0.43) TACR1CCR1CNR1GPR119JAK2
SCHEMBL5394686 0.82 TACR1 (0.44) TACR1GPR119JAK2JAK1MAPT
SCHEMBL5389958 0.81 TACR1 (0.52) TACR1GPR119JAK2JAK1MAPT
SCHEMBL6261048 0.80 TACR1 (0.51) TACR1
SCHEMBL5400644 0.79 TACR1 (0.56) TACR1CETP
SCHEMBL5398236 0.78 TACR1 (0.57) TACR1
SCHEMBL5394205 0.78 GPR119 (0.52) TACR1CNR1GPR119MAPTSTS
SCHEMBL6263440 0.78 CCR1 (0.43) TACR1CCR1MAPTHTTSMN1; SMN2

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
US-7214680-B2 2-substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors GLAXO GROUP LIMITED (GB) 2007-05-08 US disclosed
US-20040242592-A1 2-Substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors GLAXO GROUP LIMITED (GB) 2004-12-02 US disclosed
EP-1423117-A1 2-SUBSTITUTED 1-ARYLPIPERAZINES AS TACHYKININ ANTAGONISTS AND/OR SEROTONIN REUPTAKE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-06-02 EP disclosed
WO-2003015784-A1 2-SUBSTITUTED 1-ARYLPIPERAZINES AS TACHYKININ ANTAGONISTS AND/OR SEROTONIN REUPTAKE INHIBITORS GLAXO GROUP LIMITED (GB) 2003-02-27 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-20040242592-A1 2-Substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors SLC6A4, TPH1, HTR1D TACR1 49/4885CCR1 346/4885CNR1 92/4885

“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.