SCHEMBL5424596

SCHEMBL5424596

Fc1cc(Br)ccc1Sc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 3/20 0.38
LMNA P02545 3/20 0.38
RAB9A P51151 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
TP53 P04637 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK14 Q16539 2/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PDE7A Q13946 2/20 0.36
PDE7B Q9NP56 1/20 0.36

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
SCHEMBL2003379 0.82 SLC6A2 (0.40) SMN1; SMN2NPC1LMNARAB9AALDH1A1
SCHEMBL29722938 0.80 MAPK14 (0.42) ALDH1A1HPGDMAPK14MAPTKDM4E
SCHEMBL777382 0.80 MAPK14 (0.42) ALDH1A1HPGDMAPK14MAPTKDM4E
SCHEMBL810478 0.77 ALDH1A1 (0.45) SMN1; SMN2LMNAALDH1A1HPGDMAPT
SCHEMBL8737041 0.77 HTR1A (0.48) LMNAALDH1A1HPGDTP53ALOX12
SCHEMBL19180560 0.77 MAPT (0.41) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL15208335 0.77 MAPK14 (0.49) MAPK14PDE7A
SCHEMBL6618936 0.75 MAPK14 (0.36) MAPK14PDE7ADGAT1KDM1A
SCHEMBL777473 0.74 HAO1 (0.46) SMN1; SMN2ALDH1A1HPGDMAPTKDM4E
SCHEMBL29722885 0.74 HAO1 (0.46) SMN1; SMN2ALDH1A1HPGDMAPTKDM4E

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
US-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 US disclosed
EP-1799658-A2 MODULATORS OF CRTH2 REZEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES AstraZeneca AB (SE) 2007-06-27 EP disclosed
WO-2006037982-A2 MODULATORS OF CRTH2 RECEPTOR ACTIVITY FOR THE TREATMENT OF PROSTAGLANDIN D2 MEDIATED DISEASES ASTRAZENECA AB (SE) 2006-04-13 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-20070249686-A1 Modulators of Crth-2 Receptor Activity for the Treatment of Prostaglandin D2 Mediated Diseases PTGDR2, PTGDR, PTGER2 SMN1; SMN2 3741/4885NPC1 2257/4885LMNA 3601/4885

“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.