SCHEMBL1820732

SCHEMBL1820732

CCOc1ccc(-c2ccc(CCl)cc2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.47
PIK3CD O00329 1/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
PI4KA P42356 1/20 0.46
PIK3CG P48736 1/20 0.46
PI4KB Q9UBF8 1/20 0.46
MAPT P10636 2/20 0.44
CNR1 P21554 1/20 0.44
KDR P35968 3/20 0.39
TEK Q02763 2/20 0.39
ELOVL1 Q9BW60 1/20 0.38
ACACB O00763 4/20 0.38
FFAR2 O15552 1/20 0.38
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL1845243 0.85 MAPT (0.49) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL1662258 0.85 PIK3CD (0.55) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
Hydrochloric Acid SCHEMBL10483927 0.84 MAPT (0.47) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL1819377 0.83 MAPT (0.47) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL1819910 0.83 CYP19A1 (0.47) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
Bromide SCHEMBL12005941 0.81 CYP19A1 (0.46) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL17450617 0.80 MAPT (0.51) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL30268442 0.80 MAPT (0.51) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL8969725 0.79 MAPT (0.54) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL7278725 0.79 CYP19A1 (0.64) CYP19A1PIK3CDPIK3CAPIK3CBPI4KA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496571-A2 PROCESSES FOR THE PREPARATION OF 5-LIPOOXYGENASE ACTIVATING PROTEIN INHIBITORS AND THEIR INTERMEDIATES Glaxo Group Limited (GB) 2012-09-12 EP disclosed
US-20120220779-A1 Novel Processes GLAXO GROUP LIMITED (GB) 2012-08-30 US disclosed
US-20120220779-A1 Novel Processes GLAXO GROUP LIMITED (GB) 2012-08-30 US disclosed
US-20120220779-A1 Novel Processes GLAXO GROUP LIMITED (GB) 2012-08-30 US disclosed
WO-2011054783-A2 NOVEL PROCESSES GLAXO GROUP LIMITED (GB) 2011-05-12 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-20120220779-A1 Novel Processes ALOX5, PNPO, ALOX5AP CYP19A1 727/4885PIK3CD 1536/4885PIK3CA 1097/4885

“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.