SCHEMBL883840

SCHEMBL883840

CCS(=O)(=O)c1ccc(Oc2cc(C#N)cc(C(=O)OC)c2)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.44
EPAS1 Q99814 5/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
RORC P51449 3/20 0.38
FFAR1 O14842 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
BRD4 O60885 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL2065555 0.86 USP2 (0.43) EPAS1USP2GAATSHRHTT
SCHEMBL10144402 0.82 PTGDR2 (0.45) EPAS1PTGDR2RORCFFAR1
SCHEMBL885411 0.73 PTGDR2 (0.48) HTTPTGDR2
SCHEMBL4637496 0.72 PTGDR2 (0.40) EPAS1SMN1; SMN2PTGDR2FLT1FLT4
SCHEMBL4603066 0.71 MEN1 (0.49) MRGPRX4GAAHTTSMN1; SMN2RORC
SCHEMBL1652886 0.71 EPAS1 (0.45) EPAS1PTGDR2
SCHEMBL1651360 0.71 EPAS1 (0.49) EPAS1PTGDR2
SCHEMBL28676041 0.70 USP2 (0.49) USP2GAACYP11B1CYP11B2
SCHEMBL851528 0.70 FFAR1 (0.52) MRGPRX4GAAFFAR1
SCHEMBL4604063 0.70 MRGPRX4 (0.45) MRGPRX4USP2GAAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US claimed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US claimed
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP claimed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO claimed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 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 (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-20090192163-A1 Novel Compounds PAH, PC, DDC MRGPRX4 1071/4885EPAS1 864/4885USP2 1003/4885

“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.