SCHEMBL4501344

SCHEMBL4501344

O=c1nc(NCC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)[nH]c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.51
ACHE P22303 2/20 0.48
KMT2A Q03164 3/20 0.46
SIGMAR1 Q99720 3/20 0.46
MEN1 O00255 2/20 0.46
ATM Q13315 1/20 0.46
RCE1 Q9Y256 1/20 0.46
CLPP Q16740 2/20 0.45
CCR3 P51677 4/20 0.44

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
SCHEMBL4502894 0.89 ACHE (0.60) ACHE
SCHEMBL4491399 0.86 OPRM1 (0.49) OPRM1ACHEKMT2ASIGMAR1MEN1
SCHEMBL4500070 0.85 CXCR4 (0.53) OPRM1ACHEATM
SCHEMBL4499874 0.81 DCPS (0.45) OPRM1ACHEKMT2ASIGMAR1MEN1
SCHEMBL4502250 0.81 ACHE (0.48) OPRM1ACHEKMT2ASIGMAR1MEN1
SCHEMBL4503813 0.79 PARP1 (0.54) KMT2ASIGMAR1MEN1CCR3
SCHEMBL4502362 0.77 CACNA1G (0.45) OPRM1KMT2ASIGMAR1MEN1CCR3
SCHEMBL4502368 0.76 OPRM1 (0.40) OPRM1ACHEKMT2ASIGMAR1MEN1
SCHEMBL4516525 0.76 TP53 (0.49) OPRM1KMT2ASIGMAR1MEN1CCR3
SCHEMBL4503740 0.75 PDGFRB (0.56) KMT2AMEN1

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
US-7517875-B2 Piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-14 US disclosed
US-20070032525-A1 Piperidine derivatives having ccr3 antagonism TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-08 US disclosed
EP-1502916-A1 PIPERIDINE DERIVATIVES HAVING CCR3 ANTAGONISM TEIJIN LIMITED (JP) 2005-02-02 EP 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-20070032525-A1 Piperidine derivatives having ccr3 antagonism CCR3, CCR1, CCR4 OPRM1 388/4885ACHE 4551/4885KMT2A 3261/4885

“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.