SCHEMBL4315262

SCHEMBL4315262

CCOc1cc(C(=O)C(=O)c2ccc(OC(F)F)c(C)c2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 3/20 0.47
▸ TAS1R1 Q7RTX1 3/20 0.47
▸ RAB9A P51151 4/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ REN P00797 1/20 0.41
▸ CTSD P07339 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ PDE4A P27815 4/20 0.39
▸ PDE4B Q07343 4/20 0.39
▸ PDE4C Q08493 4/20 0.39

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
SCHEMBL4309806 0.88 BACE1 (0.40) RENCTSDBACE1BACE2TSHR
SCHEMBL4309920 0.87 BACE1 (0.41) RENCTSDBACE1BACE2PDE4A
SCHEMBL4308405 0.87 REN (0.41) RENCTSDBACE1BACE2TSHR
SCHEMBL2797936 0.85 CES2 (0.44) RAB9AMEN1KMT2ALMNAMAPK1
SCHEMBL4304460 0.85 PDE4B (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL4322471 0.85 TSHR (0.42) RAB9AMAPK1MAPTKDM4EHTT
SCHEMBL4309410 0.84 CES2 (0.44) TAS1R3TAS1R1RAB9AMEN1KMT2A
SCHEMBL21387011 0.81 HDAC1 (0.46) RAB9AMEN1KMT2ALMNAMAPK1
SCHEMBL4313438 0.81 CES2 (0.40) RAB9AMEN1KMT2ALMNAMAPK1
SCHEMBL4312458 0.80 REN (0.45) TAS1R3TAS1R1RAB9AMEN1KMT2A

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-2137161-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5- PHENYLIMIDAZOLONE COMPOUNDS AS ß-SECRETASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-12-30 — — EP disclosed
US-20090042964-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5-PHENYLIMIDAZOLONE COMPOUNDS AS BETA-SECRETASE INHIBITORS WYETH (US) 2009-02-12 — — US disclosed
WO-2008115552-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5- PHENYLIMIDAZOLONE COMPOUNDS AS ß-SECRETASE INHIBITORS WYETH (US) 2008-09-25 — — 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-20090042964-A1 AMINO-5-[SUBSTITUTED-4-(DIFLUOROMETHOXY)PHENYL]-5-PHENYLIMIDAZOLONE COMPOUNDS AS BETA-SECRETASE INHIBITORS BACE1, BACE2, APP TAS1R3 4178/4885TAS1R1 4088/4885RAB9A 2352/4885

“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.

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