SCHEMBL2817620

SCHEMBL2817620

O=C1NCC(c2ccccc2)CC1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.45
CRBN Q96SW2 1/20 0.45
PDE4D Q08499 2/20 0.45
HDAC8 Q9BY41 2/20 0.39
NAAA Q02083 3/20 0.39
MAPK1 P28482 1/20 0.39
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A3 Q01959 2/20 0.37
MAOB P27338 1/20 0.37
HSD11B1 P28845 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
SCHEMBL2799823 0.77 PDE4D (0.57) PDE4DMAPK1
SCHEMBL4442028 0.77 PDE4D (0.61) PDE4D
SCHEMBL2801940 0.77 PDE4D (0.61) PDE4D
SCHEMBL2798678 0.77 PDE4D (0.61) PDE4D
SCHEMBL2801773 0.76 PDE4D (0.60) PDE4DALDH1A1
SCHEMBL2799859 0.76 PDE4D (0.60) PDE4DALDH1A1
SCHEMBL4438899 0.76 PDE4D (0.60) PDE4DALDH1A1
SCHEMBL11663631 0.75 DDB1 (0.43) DDB1CRBNSLC6A3
SCHEMBL2798432 0.74 PDE4D (0.83) PDE4DMAPK1ALDH1A1KMT2A
SCHEMBL2801312 0.74 PDE4D (0.83) PDE4DMAPK1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168167-A1 Piperidinones Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-07-01 US disclosed
US-20100168170-A1 Piperidinones Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-07-01 US disclosed
EP-2137150-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2009-12-30 EP disclosed
EP-2134686-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2009-12-23 EP disclosed
WO-2008110794-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-09-18 WO disclosed
WO-2008110793-A1 PIPERIDINONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-09-18 WO disclosed
WO-2004031149-A1 SUBSTITUTED GAMMA-PHENYL-DELTA-LACTAMS AND USES RELATED THERETO INFLAZYME PHARMACEUTICALS LTD. (CA) 2004-04-15 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-20100168170-A1 Piperidinones Useful in the Treatment of Inflammation ARG1, ARG2, PRMT1 DDB1 3645/4885CRBN 2073/4885PDE4D 1120/4885
US-20100168167-A1 Piperidinones Useful in the Treatment of Inflammation ARG1, ARG2, PRMT1 DDB1 3634/4885CRBN 1793/4885PDE4D 1438/4885

“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.