SCHEMBL5249495

SCHEMBL5249495

OCCCOc1ccccc1Cc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 12/20 0.66
HPGD P15428 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
TP53 P04637 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2C9 P11712 1/20 0.64
TSHR P16473 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
LMNA P02545 1/20 0.62
DRD1 P21728 6/20 0.61
DRD4 P21917 5/20 0.61
DRD5 P21918 5/20 0.61
DRD2 P14416 4/20 0.61
DRD3 P35462 4/20 0.59
HTR1A P08908 1/20 0.51
ADRA1D P25100 1/20 0.51
ADRA1A P35348 1/20 0.51
ADRA1B P35368 1/20 0.51

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
SCHEMBL4350513 0.91 HPGD (0.67) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL5248594 0.89 TP53 (0.65) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL8504454 0.89 HRH1 (0.50) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL7755733 0.85 HPGD (0.59) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL5256025 0.84 HTR1A (0.64) DRD2HTR1A
SCHEMBL8409019 0.83 PTGER1 (0.54) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL5146718 0.82 HRH1 (0.71) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL11033196 0.82 HPGD (0.81) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL5004014 0.82 HRH1 (0.66) HRH1HPGDSMN1; SMN2TP53CYP1A2
SCHEMBL9774142 0.81 HRH1 (0.60) HRH1HPGDSMN1; SMN2TP53CYP1A2

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-1260512-B1 NOVEL CYCLIC AMIDE DERIVATIVES MITSUBISHI PHARMA CORP (JP) 2007-07-04 EP disclosed
US-7166617-B2 Cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-01-23 US disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 EP 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-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 HRH1 226/4885HPGD 2713/4885SMN1; SMN2 4778/4885

“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.