SCHEMBL6039802

SCHEMBL6039802

c1ccc(CCN2CCC(c3nc(-c4ccccc4)c4ccccn34)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.57
DRD4 P21917 5/20 0.47
DRD2 P14416 4/20 0.47
DRD3 P35462 3/20 0.47
ACHE P22303 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
KCNH2 Q12809 1/20 0.46
MEN1 O00255 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
KMT2A Q03164 2/20 0.45
CCR3 P51677 1/20 0.45
SIGMAR1 Q99720 2/20 0.43
TP53 P04637 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL6039483 0.92 DRD4 (0.58) PRCPDRD4DRD2DRD3ACHE
SCHEMBL6039497 0.92 PRCP (0.52) PRCPDRD4DRD2DRD3MEN1
SCHEMBL6039470 0.90 PRCP (0.47) PRCPDRD4DRD2DRD3ACHE
SCHEMBL6039970 0.90 SIGMAR1 (0.47) PRCPDRD4DRD2DRD3KCNH2
SCHEMBL6366585 0.86 PRCP (0.52) PRCPDRD4DRD2DRD3ACHE
SCHEMBL6039542 0.83 KCNH2 (0.45) PRCPKCNH2SIGMAR1
SCHEMBL6039487 0.80 HRH1 (0.48) DRD4DRD2DRD3HTR2AHTR2C
SCHEMBL6039513 0.80 PRCP (0.48) PRCPDRD4DRD2DRD3ACHE
SCHEMBL6039928 0.79 SIGMAR1 (0.47) PRCPDRD4DRD2DRD3MEN1
SCHEMBL6362602 0.78 KMT2A (0.37) PRCPDRD3KCNH2MEN1KMT2A

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-1664042-A1 IMIDAZO 1,5-a PYRIDINE OR IMIDAZO 1,5-a PIPERIDINE DERIVATIVES AND THEIR USE FOR THE PREPARATION OF MEDICAMENT AGAINST 5-HT2A RECEPTOR-RELATED DISORDERS Galapagos N.V. (BE) 2006-06-07 EP claimed
US-20050215555-A1 Imidazo[1,5-a]pyridine serotonin (5-HT) 5-HT2A receptor antagonists such as 1-phenyl-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine; psychological disorders, sleep disorders, addiction, cardiovascular disorders, epilepsy, glaucoma BLOVITRUM AB (SE) 2005-09-29 US claimed
WO-2005021545-A1 IMIDAZO[1,5-a]PYRIDINE OR IMIDAZO[1,5-a]PIPERIDINE DERIVATIVES AND THEIR USE FOR THE PREPARATION OF MEDICAMENT AGAINST 5-HT2A RECEPTOR-RELATED DISORDERS GALAPAGOS NV (BE) 2005-03-10 WO claimed

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-20050215555-A1 Imidazo[1,5-a]pyridine serotonin (5-HT) 5-HT2A receptor antagonists such as 1-phenyl-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine; psychological disorders, sleep disorders, addiction, cardiovascular disorders, epilepsy, glaucoma HTR1A, HTR2A, HTR5A PRCP 2350/4885DRD4 384/4885DRD2 132/4885

“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.