SCHEMBL5554028

SCHEMBL5554028

CC(c1ccc(-c2ccc(-c3cccc(CO)c3)cc2)cc1)N(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.50
PTGS2 P35354 2/20 0.48
MGLL Q99685 2/20 0.45
ADAMTS4 O75173 1/20 0.45
ACMSD Q8TDX5 1/20 0.43
SDCBP O00560 1/20 0.41
SDC2 P34741 1/20 0.41
DHODH Q02127 1/20 0.41
FYN P06241 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
FGFR1 P11362 1/20 0.40
PTGES O14684 1/20 0.39
BCL2 P10415 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39

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
SCHEMBL6447082 0.83 CSF1R (0.40) MGLLADAMTS4
SCHEMBL11141687 0.77 ALOX5 (0.40) PTGS2
SCHEMBL18297788 0.77 PRKCI (0.76) PRKCIADAMTS4ACMSDFYNCHRNB4
SCHEMBL7326388 0.77 AOC3 (0.58) PRKCIMGLLACMSDFYNCHRNB4
SCHEMBL19567243 0.76 PRKCI (0.54) PRKCIPTGS2MGLLADAMTS4ACMSD
SCHEMBL16578698 0.75 PRKCI (0.68) PRKCIMGLLADAMTS4ACMSDFYN
SCHEMBL4191589 0.75 PRKCI (0.72) PRKCIACMSDFYNCHRNB4CHRNA3
SCHEMBL1520795 0.74 PRKCI (0.61) PRKCIMGLLADAMTS4ACMSDDHODH
SCHEMBL5549959 0.74 PRKCI (0.45) PRKCIPTGS2MGLLADAMTS4ACMSD
SCHEMBL249824 0.73 PRKCI (0.70) PRKCIACMSDFYNCHRNB4CHRNA3

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
EP-1756058-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-02-28 EP claimed
WO-2005105744-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. 2005-11-10 WO claimed
US-20050245543-A1 Histamine-3 receptor antagonists PFIZER INC 2005-11-03 US claimed
US-20050245543-A1 Histamine-3 receptor antagonists PFIZER INC 2005-11-03 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-20050245543-A1 Histamine-3 receptor antagonists HRH3, HRH4, HRH2 PRKCI 4493/4885PTGS2 2955/4885MGLL 2138/4885

“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.