SCHEMBL4183735

SCHEMBL4183735

CCCCC(=O)c1cc(Cl)c(N2CCC(C(=O)OC(C)(C)C)CC2)nc1CN1CCCC1=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
RORC P51449 2/20 0.32
ALDH1A1 P00352 4/20 0.32
NPC1 O15118 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK1 P28482 1/20 0.32
HTR4 Q13639 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
ACHE P22303 1/20 0.31
PDE4A P27815 1/20 0.31

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
SCHEMBL4179105 0.95 P2RY12 (0.34) MAPTRORCALDH1A1NPC1KDM4E
SCHEMBL4164145 0.89 MPL (0.37) RORCKDM4EHPGDHSD17B10MAPK1
SCHEMBL4168805 0.89 RORC (0.32) MAPTRORCHTR4
SCHEMBL4171958 0.88 MAPK1 (0.35) MAPTRORCALDH1A1NPC1KDM4E
SCHEMBL4165236 0.88 P2RY12 (0.43) MAPTALDH1A1KDM4EGAAHPGD
SCHEMBL4169013 0.88 RORC (0.34) MAPTRORCALDH1A1NPC1KDM4E
SCHEMBL4892954 0.87 MAPT (0.39) MAPTALDH1A1NPC1KDM4EHSD17B10
SCHEMBL4165173 0.87 OPRK1 (0.35) MAPTRORCALDH1A1KDM4EGLA
SCHEMBL4805982 0.85 OPRK1 (0.35) MAPTRORCKMT2ALMNA
SCHEMBL3941725 0.84 P2RY12 (0.39) RORCKDM4EHPGDHSD17B10MAPK1

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-20090018166-A1 New Pyridine Analogues X 161 ASTRAZENECA AB (SE) 2009-01-15 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-20090018166-A1 New Pyridine Analogues X 161 P2RY12, P2RY11, P2RY1 MAPT 3645/4885RORC 460/4885ALDH1A1 1717/4885

“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.