SCHEMBL137172

SCHEMBL137172

CCOC(=O)Cc1ccc(OC)c(-c2ccc(C)cc2CNC(=O)NCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.51
PPID Q08752 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
PTPN1 P18031 1/20 0.45
RECQL P46063 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TBXA2R P21731 2/20 0.42
PTGDR Q13258 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
PTGIR P43119 1/20 0.42

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
SCHEMBL137314 0.90 PTGDR2 (0.58) PTGDR2SMN1; SMN2PTPN1KMT2AALDH1A1
SCHEMBL150116 0.88 PTGDR2 (0.67) PTGDR2PPIDTBXA2RPTGDRCYP3A4
SCHEMBL12900609 0.86 PTGDR2 (0.67) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL135903 0.84 PTGDR2 (0.46) PTGDR2RECQLPOLBL3MBTL1TBXA2R
SCHEMBL12197389 0.83 ABL1 (0.46) PTGDR2RECQLL3MBTL1TBXA2RPTGDR
SCHEMBL134660 0.83 PTGDR2 (0.54) PTGDR2RECQLKMT2AALDH1A1TBXA2R
SCHEMBL137171 0.83 PTGDR2 (0.67) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL12197396 0.82 PTGDR2 (0.45) PTGDR2RECQLTBXA2RPTGDRCYP3A4
SCHEMBL149940 0.82 L3MBTL1 (0.45) PTGDR2PPIDSMN1; SMN2PTPN1RECQL
SCHEMBL137784 0.82 PTGDR2 (0.58) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9

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 PTGDR2 2/4885PPID 791/4885SMN1; SMN2 4708/4885
US-20110039852-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885PPID 791/4885SMN1; SMN2 4708/4885
US-20120058123-A1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PTGDR2 2/4885PPID 791/4885SMN1; SMN2 4708/4885

“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.