SCHEMBL6322742

SCHEMBL6322742

Cc1cc(N2CCCC2)ccc1[C@H]1C[C@H](CN2CCC(Oc3ccc(Cl)cc3)CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 13/20 0.43
CCR3 P51677 13/20 0.43
KCNH2 Q12809 10/20 0.43
OPRK1 P41145 1/20 0.41
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
PLA2G1B P04054 1/20 0.37
POLB P06746 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL6322746 1.00 HRH1 (0.43) HRH1CCR3KCNH2OPRK1MAOA
SCHEMBL6329232 0.78 GAA (0.49) KCNH2MEN1LMNAKMT2A
SCHEMBL6329235 0.78 GAA (0.49) KCNH2MEN1LMNAKMT2A
SCHEMBL6322581 0.76 KDM4E (0.44) HRH1MEN1LMNAKMT2A
SCHEMBL6322573 0.76 KDM4E (0.44) HRH1MEN1LMNAKMT2A
SCHEMBL5789326 0.73 HRH3 (0.59) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL5789325 0.73 HRH3 (0.59) HRH1CCR3KCNH2MAOAMAOB
SCHEMBL6321430 0.70 SIGMAR1 (0.37)
SCHEMBL4966743 0.69 HRH1 (0.82) HRH1CCR3KCNH2OPRK1
SCHEMBL6330742 0.69 HPGD (0.39) MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050171181-A1 3-Benzyloxymethyl-1-(4-pyrrolidin-1-ylmethyl-phenyl)-cyclobutanol for example; treating allergies and mood disorders; use in combination with a histamine H1 antagonist or a neurotransmitter re-uptake blocker PFIZER INC 2005-08-04 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-20050171181-A1 3-Benzyloxymethyl-1-(4-pyrrolidin-1-ylmethyl-phenyl)-cyclobutanol for example; treating allergies and mood disorders; use in combination with a histamine H1 antagonist or a neurotransmitter re-uptake blocker HRH3, HRH4, HRH1 HRH1 3/4885CCR3 548/4885KCNH2 1142/4885

“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.