SCHEMBL135154

SCHEMBL135154

CCOC(=O)Cc1cc(Cl)cc(OS(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
MAOB P27338 1/20 0.39
KMT2A Q03164 4/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 3/20 0.38
KDM4E B2RXH2 3/20 0.38
LMNA P02545 2/20 0.38
FPR1 P21462 1/20 0.38
CYP4Z1 Q86W10 1/20 0.37
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.35
HTT P42858 1/20 0.35
POLB P06746 2/20 0.35
ABCB1 P08183 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL153427 0.85 MAPT (0.39) MAPTMAOBKMT2AHPGDMEN1
SCHEMBL136484 0.83 MAOB (0.39) MAOBKMT2AMEN1KDM4ELMNA
SCHEMBL6367851 0.82 MAPT (0.51) MAPTMAOBKMT2AHPGDMEN1
SCHEMBL136465 0.80 RXRA (0.39) MAPTLMNAALDH1A1HTTPOLB
SCHEMBL137425 0.79 HSP90AB1 (0.51) MAPTMAOBKMT2AHPGDMEN1
SCHEMBL8222011 0.79 KDM4E (0.36) MAPTKDM4ELMNAALDH1A1HTT
SCHEMBL3153601 0.78 POLB (0.46) MAPTMAOBKMT2AMEN1CYP4Z1
SCHEMBL31225523 0.78 MAOB (0.42) MAPTMAOBKMT2AHPGDMEN1
SCHEMBL6372557 0.77 MAPT (0.48) MAPTMAOBKMT2AHPGDMEN1
SCHEMBL134983 0.75 MAPT (0.46) MAPTMAOBKMT2AHPGDMEN1

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
US-20130158036-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PANMIRA PHARMACEUTICALS, LLC (US) 2013-06-20 US disclosed
US-8362044-B2 N,N-disubstituted aminoalkylbiphenyl antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-01-29 US disclosed
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PANMIRA PHARMACEUTICALS, LLC. (US) 2012-03-08 US disclosed
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-02-17 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 (3 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-20130158036-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 MAPT 4866/4885MAOB 1134/4885KMT2A 4559/4885
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 MAPT 4866/4885MAOB 1134/4885KMT2A 4559/4885
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 MAPT 4866/4885MAOB 1134/4885KMT2A 4559/4885

“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.