SCHEMBL7228479

SCHEMBL7228479

N#Cc1ccc(-c2ccc(OCCCCl)c(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 7/20 0.56
▸ KIF11 P52732 2/20 0.48
▸ HRH2 P25021 4/20 0.40
▸ HRH1 P35367 4/20 0.40
▸ MMP2 P08253 2/20 0.39
▸ MMP3 P08254 3/20 0.38
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ MMP1 P03956 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP13 P45452 1/20 0.37

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
SCHEMBL1714334 0.88 HRH3 (0.43) HRH3
SCHEMBL9062436 0.85 HRH3 (0.55) HRH3KIF11HDAC1HDAC2
SCHEMBL7223288 0.84 MRGPRX4 (0.42) HRH3HRH2HRH1MMP2MMP3
SCHEMBL6847271 0.84 HRH3 (0.55) HRH3KIF11HRH2HRH1MMP2
SCHEMBL7226578 0.82 HRH3 (0.42) HRH3HRH2HRH1MMP2MMP3
SCHEMBL7220649 0.82 HRH3 (0.40) HRH3HRH2HRH1MMP2MMP3
SCHEMBL7222806 0.81 KIT (0.46) HRH3HRH2HRH1
SCHEMBL25040867 0.81 HRH3 (0.49) HRH3KIF11MMP2MMP3HDAC1
SCHEMBL7228230 0.79 HRH3 (0.48) HRH3KIF11HRH2HRH1MMP2
SCHEMBL25040490 0.79 HRH3 (0.50) HRH3KIF11MMP2MMP3HDAC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620839-B2 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBOTT LABORATORIES 2003-09-16 — — US disclosed
US-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2002-09-26 — — 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-20020137931-A1 1,3-disubstituted and 1,3,3-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 HRH3 1/4885KIF11 4688/4885HRH2 4/4885

“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.

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