SCHEMBL4492747

SCHEMBL4492747

Cc1ccc2[nH]c(=O)oc(=O)c2c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 4/20 0.44
NOS2 P35228 3/20 0.43
F2 P00734 1/20 0.43
CFD P00746 1/20 0.43
NOS3 P29474 2/20 0.41
PDGFRA P16234 1/20 0.39
MAPK8 P45983 1/20 0.39
CDK5 Q00535 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
AR P10275 4/20 0.38
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
OGT O15294 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 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
SCHEMBL4502778 0.82 NOS1 (0.42) NOS1NOS2F2CFDNOS3
SCHEMBL4491356 0.82 NOS1 (0.42) NOS1NOS2F2CFDNOS3
SCHEMBL6508140 0.82 ESR1 (0.44) NOS1NOS2F2CFDNOS3
SCHEMBL4490244 0.80 AR (0.45) NOS1NOS2F2CFDNOS3
SCHEMBL6496075 0.80 NOS1 (0.40) NOS1NOS2F2CFDNOS3
SCHEMBL23137519 0.79 NOS1 (0.48) NOS1NOS2F2CFDNOS3
SCHEMBL619937 0.78 F2 (0.52) NOS1NOS2F2CFDNOS3
SCHEMBL6930556 0.77 ALDH1A1 (0.41) NOS1NOS2F2CFDNOS3
SCHEMBL5331026 0.77 CDK1 (0.41) NOS1NOS2F2CFDNOS3
SCHEMBL6496586 0.76 CREBBP (0.38) NOS1NOS2F2CFDNOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524841-B2 4,4-disubstituted piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-28 US disclosed
US-7517875-B2 Piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-14 US disclosed
CN-100360521-C 4,4-disubstituted piperidine derivatives having CCR3 antagonism TEIJIN LTD (JP) 2008-01-09 CN disclosed
US-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-15 US disclosed
US-20070032525-A1 Piperidine derivatives having ccr3 antagonism TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-08 US disclosed
CN-1665804-A 4, 4-disubstituted piperidine derivatives having CCR3 antagonism TEIJIN LTD (JP) 2005-09-07 CN disclosed
CN-1659161-A Piperidine derivatives having CCR3 antagonism TEIJIN LTD (JP) 2005-08-24 CN disclosed
EP-1505067-A1 4,4-DISUBSTITUTED PIPERIDINE DERIVATIVES HAVING CCR3 ANTAGONISM TEIJIN LIMITED (JP) 2005-02-09 EP 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 (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-20070032525-A1 Piperidine derivatives having ccr3 antagonism CCR3, CCR1, CCR4 NOS1 2705/4885NOS2 2674/4885F2 4357/4885
US-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells CCR3, CCR1, CCR4 NOS1 2144/4885NOS2 2452/4885F2 2131/4885

“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.