SCHEMBL22166261

SCHEMBL22166261

Cc1cc(COc2ccccc2)ccc1B(O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.46
FFAR1 O14842 6/20 0.46
APP P05067 1/20 0.46
ENPP2 Q13822 2/20 0.45
F10 P00742 1/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43
CYP2C19 P33261 1/20 0.43
PTGS2 P35354 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HIF1A Q16665 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MAOB P27338 2/20 0.42
FFAR4 Q5NUL3 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL539890 0.84 LIPE (0.54) LIPELMNACYP1A2PTGS1SLC6A2
SCHEMBL29950569 0.84 LIPE (0.54) LIPELMNACYP1A2PTGS1SLC6A2
SCHEMBL29954329 0.78 TUBB4A (0.48) LIPEENPP2F10LMNAMAOB
SCHEMBL23273767 0.77 MAOB (0.49) APPF10MAOBMAPT
SCHEMBL8497207 0.76 RXRA (0.59) FFAR1LMNAMAOBALDH1A1MAPT
SCHEMBL14518225 0.76 LMNA (0.53) FFAR1APPF10LMNACYP1A2
SCHEMBL2553220 0.74 ENPP2 (0.51) FFAR1APPENPP2MAPT
SCHEMBL16295658 0.74 LIPE (0.54) LIPELMNACYP1A2PTGS1SLC6A2
SCHEMBL177615 0.74 APP (0.58) LIPEFFAR1APPLMNACYP1A2
SCHEMBL2560315 0.74 ENPP2 (0.54) APPENPP2MAOBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696658-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2020-06-30 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-10696658-B2 Heteroaromatic compounds and their use as dopamine D1 ligands DRD1, SNCA, DRD2 LIPE 2282/4885FFAR1 859/4885APP 145/4885

“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.