SCHEMBL2875520

SCHEMBL2875520

COc1cccc(CCNS(=O)(=O)c2cc(-c3cc4ccccc4[nH]3)ccc2Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.54
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
CNR1 P21554 4/20 0.44
AKR1C3 P42330 1/20 0.44
POLB P06746 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
MGAM O43451 1/20 0.39

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
SCHEMBL2874911 0.91 CNR1 (0.52) ACLYALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL2872855 0.88 MGAM (0.44) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL2872849 0.83 MGAM (0.46) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL2875369 0.82 POLB (0.50) ALDH1A1MAPTNPC1RAB9AKDM4E
SCHEMBL2872278 0.79 ACLY (0.51) ACLYALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL2873463 0.79 ACLY (0.51) ACLYALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL2873169 0.79 ACLY (0.51) ACLYALDH1A1SMN1; SMN2MAPTCNR1
SCHEMBL3998451 0.78 ACLY (0.50) ACLYALDH1A1SMN1; SMN2MAPTCNR1
SCHEMBL2875009 0.77 ACLY (0.65) ACLYALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL2872499 0.76 MGAM (0.46) ALDH1A1MAPTNPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066628-B1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI AVENTIS (FR) 2010-10-20 EP disclosed
US-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2009-07-09 US disclosed
EP-2066628-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS Sanofi-Aventis (FR) 2009-06-10 EP disclosed
WO-2008014186-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS SANOFI-AVENTIS (FR) 2008-01-31 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-20090176804-A1 2-PHENYL-INDOLES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS PTGER2, PTGDR2, CYSLTR2 ACLY 4136/4885ALDH1A1 1757/4885SMN1; SMN2 3283/4885

“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.