SCHEMBL5226220

SCHEMBL5226220

COCCCO[C@@H]1CCN(Cc2ccc(-c3ccc(-c4noc(C)n4)cc3)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
KCNH2 Q12809 2/20 0.42
GPR119 Q8TDV5 1/20 0.42
HTT P42858 1/20 0.40
S1PR1 P21453 7/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MITF O75030 1/20 0.39
S1PR4 O95977 2/20 0.38
S1PR5 Q9H228 2/20 0.38
MCHR1 Q99705 1/20 0.38
S1PR3 Q99500 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 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
SCHEMBL5223246 1.00 POLB (0.45) POLBKCNH2GPR119HTTS1PR1
SCHEMBL5223251 1.00 POLB (0.45) POLBKCNH2GPR119HTTS1PR1
SCHEMBL5928296 0.94 KCNH2 (0.43) POLBKCNH2GPR119HTTS1PR1
SCHEMBL5928300 0.94 KCNH2 (0.43) POLBKCNH2GPR119HTTS1PR1
SCHEMBL5222459 0.89 KCNH2 (0.43) KCNH2GPR119S1PR1RAB9ALMNA
SCHEMBL5221845 0.89 KCNH2 (0.43) KCNH2GPR119S1PR1RAB9ALMNA
SCHEMBL5221834 0.89 KCNH2 (0.43) KCNH2GPR119S1PR1RAB9ALMNA
SCHEMBL5224117 0.87 LTA4H (0.46) KCNH2GPR119HTTS1PR1RAB9A
SCHEMBL5224103 0.87 LTA4H (0.46) KCNH2GPR119HTTS1PR1RAB9A
SCHEMBL5221218 0.86 KCNH2 (0.44) KCNH2GPR119HTTS1PR1RAB9A

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-20060019998-A1 Histamine-3 receptor antagonist PFIZER INC 2006-01-26 US claimed
EP-1771449-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-04-11 EP disclosed
WO-2006011043-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-02-02 WO disclosed
US-20060019998-A1 Histamine-3 receptor antagonist PFIZER INC 2006-01-26 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-20060019998-A1 Histamine-3 receptor antagonist HRH3, HRH4, HRH2 POLB 2262/4885KCNH2 909/4885GPR119 34/4885

“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.