SCHEMBL2424717

SCHEMBL2424717

CN(C)[C@H]1CCN(c2ccc(Cl)cc2C=O)C1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.45
PIM1 P11309 1/20 0.45
PIM3 Q86V86 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
HTR3A P46098 1/20 0.44
NOTUM Q6P988 2/20 0.43
WDR5 P61964 2/20 0.41
FPR1 P21462 2/20 0.41
FPR2 P25090 2/20 0.41
MCHR1 Q99705 8/20 0.41

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
SCHEMBL2424720 1.00 HRH4 (0.45) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL2420993 0.85 PIM1 (0.46) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL2420991 0.85 PIM1 (0.46) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL13538106 0.84 PIM1 (0.45) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL2425192 0.84 PIM1 (0.45) PIM1PIM3PIM2WDR5FPR1
SCHEMBL2427274 0.84 PIM1 (0.45) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL13537746 0.84 PIM1 (0.45) PIM1PIM3PIM2HTR3AWDR5
SCHEMBL2425187 0.84 PIM1 (0.45) PIM1PIM3PIM2WDR5FPR1
SCHEMBL2427272 0.84 PIM1 (0.45) HRH4PIM1PIM3PIM2HTR3A
SCHEMBL2423861 0.82 LCK (0.44) PIM1PIM3PIM2MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-20150051185-A1 Chemical Compounds 251 ASTRAZENECA AB (SE) 2015-02-19 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-8901307-B2 Chemical compounds 251 ASTRAZENECA AB (SE) 2014-12-02 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US disclosed
US-20110218182-A1 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2011-09-08 US disclosed
WO-2010001169-A2 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2010-01-07 WO 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 (2 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-20110218182-A1 CHEMICAL COMPOUNDS 251 PIM1, PIM3, PIM2 HRH4 4814/4885PIM1 1/4885PIM3 2/4885
US-20150051185-A1 Chemical Compounds 251 PIM1, PIM3, PIM2 HRH4 4835/4885PIM1 1/4885PIM3 2/4885

“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.