SCHEMBL12303142

SCHEMBL12303142

CC[C@H](C)COc1cc2ccccc2cc1CO

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.55
▸ MCHR1 Q99705 1/20 0.45
▸ GPBAR1 Q8TDU6 1/20 0.43
▸ FFAR1 O14842 1/20 0.42
▸ PDE4A P27815 1/20 0.39
▸ PDE4B Q07343 1/20 0.39
▸ PDE4C Q08493 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ GPR88 Q9GZN0 6/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ NR2E1 Q9Y466 1/20 0.38
▸ TSHR P16473 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ IGF1R P08069 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
SCHEMBL10025813 0.78 TLR8 (0.53) TLR8MCHR1GPBAR1FFAR1KDM4E
SCHEMBL15796968 0.74 TLR8 (0.49) TLR8MCHR1GPBAR1FFAR1GPR88
SCHEMBL5649980 0.74 TLR8 (0.54) TLR8MCHR1GPBAR1FFAR1KDM4E
SCHEMBL5159304 0.73 PDE4A (0.64) TLR8PDE4APDE4BPDE4CPDE4D
SCHEMBL30975093 0.73 PDE4A (0.64) TLR8PDE4APDE4BPDE4CPDE4D
SCHEMBL30975091 0.73 PDE4A (0.64) TLR8PDE4APDE4BPDE4CPDE4D
SCHEMBL12251028 0.73 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL14113223 0.72 GPBAR1 (0.58) TLR8MCHR1GPBAR1FFAR1KDM4E
SCHEMBL7330439 0.71 ELANE (0.52) CYP1A2CYP2C19L3MBTL1
SCHEMBL5885008 0.71 S1PR1 (0.37) TLR8MCHR1PDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 — — US disclosed
US-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-29 — — 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-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS DCLRE1A, AZI2, CHD9 TLR8 3680/4885MCHR1 2043/4885GPBAR1 3202/4885

“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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