SCHEMBL15466243

SCHEMBL15466243

O=C(O)C=Cc1cc2ccc(Cl)cc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.50
DAO P14920 1/20 0.47
PDGFRB P09619 1/20 0.43
FLT3 P36888 1/20 0.43
PLA2G1B P04054 1/20 0.42
MAPT P10636 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41
ITGAL P20701 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
F7 P08709 1/20 0.41
F3 P13726 1/20 0.41
ESR1 P03372 1/20 0.40
F11 P03951 1/20 0.40

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
SCHEMBL15466242 1.00 ALOX15 (0.50) ALOX15DAOPDGFRBFLT3PLA2G1B
SCHEMBL17908002 0.88 F7 (0.55) DAOFLT3MAPTITGB2ICAM1
SCHEMBL17908005 0.88 F7 (0.55) DAOFLT3MAPTITGB2ICAM1
SCHEMBL15466233 0.81 TDO2 (0.52) DAOFLT3ESR1
SCHEMBL20495245 0.81 HRH4 (0.41) HRH4
SCHEMBL15466232 0.81 TDO2 (0.52) DAOFLT3ESR1
SCHEMBL6295560 0.81 ATP6AP1 (0.53)
SCHEMBL6295563 0.81 ATP6AP1 (0.53)
SCHEMBL179872 0.79 CYP2A6 (0.58) DAOFLT3MAPTESR1
SCHEMBL245110 0.79 CYP2A6 (0.58) DAOFLT3MAPTESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2697223-B1 7-(HETEROARYL-AMINO)-6,7,8,9-TETRAHYDROPYRIDO[1,2-A]INDOL ACETIC ACID DERIVATIVES AND THEIR USE AS PROSTAGLANDIN D2 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD (CH) 2016-07-13 EP disclosed
US-9096595-B2 7-(heteroaryl-amino)-6,7,8,9-tetrahydropyrido[1,2-a]indol acetic acid derivatives and their use as prostaglandin D2 receptor modulators ACTELION PHARMACEUTICALS LTD (CH) 2015-08-04 US disclosed
US-20140045870-A1 7-(Heteroaryl-Amino)-6,7,8,9-Tetrahydropyrido[1,2-A]Indol Acetic Acid Derivatives and Their Use as Prostaglandin D2 Receptor Modulators ACTELION PHARMACEUTICALS LTD. (CH) 2014-02-13 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 (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-20140045870-A1 7-(Heteroaryl-Amino)-6,7,8,9-Tetrahydropyrido[1,2-A]Indol Acetic Acid Derivatives and Their Use as Prostaglandin D2 Receptor Modulators PTGDR, PTGDR2, PTGER1 ALOX15 76/4885DAO 802/4885PDGFRB 648/4885

“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.