SCHEMBL4499273

SCHEMBL4499273

COC(=O)c1cccc2[nH]c(NCC3CCNCC3)nc12

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.61
PKN1 Q16512 1/20 0.47
PKN2 Q16513 1/20 0.47
PIM1 P11309 1/20 0.47
PARP1 P09874 11/20 0.46
AURKA O14965 1/20 0.45
RPS6KB1 P23443 1/20 0.45
CHEK1 O14757 1/20 0.43
CHEK2 O96017 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
CRBN Q96SW2 1/20 0.42
HTR3A P46098 2/20 0.40
HTR4 Q13639 2/20 0.40

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
SCHEMBL4516401 0.88 PARP1 (0.48) RIPK1PIM1PARP1AURKARPS6KB1
Hydrochloric Acid SCHEMBL4507414 0.85 RIPK1 (0.44) RIPK1PKN1PKN2PIM1PARP1
SCHEMBL4503780 0.81 PARP1 (0.56) RIPK1PARP1HTR3AHTR4
SCHEMBL4504445 0.76 PIM1 (0.47) PKN1PKN2PIM1PARP1AURKA
SCHEMBL4504259 0.76 RIPK1 (0.47) RIPK1PARP1CRBNHTR3AHTR4
SCHEMBL4503785 0.75 RIPK1 (0.53) RIPK1PKN1PKN2PARP1PARP2
SCHEMBL17697629 0.75 CRBN (0.59) RIPK1PKN1PKN2PARP1CRBN
Hydrochloric Acid SCHEMBL4505592 0.73 KDM4E (0.43) PIM1CHEK1CHEK2HTR4
SCHEMBL4490880 0.72 PDGFRB (0.58) PIM1CHEK1HTR3A
SCHEMBL4495617 0.72 PARP1 (0.56) PARP1HTR3AHTR4

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 RIPK1 1974/4885PKN1 3509/4885PKN2 3902/4885

“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.