SCHEMBL8117484

SCHEMBL8117484

CCOC(=O)N[C@H](COc1ccc(F)cc1F)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.44
MAPT P10636 2/20 0.44
POLB P06746 2/20 0.44
FAAH O00519 2/20 0.43
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
AAK1 Q2M2I8 1/20 0.38
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38

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
SCHEMBL8121605 1.00 RAB9A (0.44) RAB9AMAPTPOLBFAAHNPC1
SCHEMBL13320913 0.85 MAPT (0.46) RAB9AMAPTPOLBFAAHNPC1
SCHEMBL17492229 0.84 AAK1 (0.54) ACEAAK1
SCHEMBL17492226 0.84 AAK1 (0.54) ACEAAK1
SCHEMBL13376991 0.80 ACE (0.40) FAAHSMN1; SMN2ACEAAK1
SCHEMBL29992146 0.77 PPARG (0.44) LMNASMN1; SMN2
SCHEMBL17492065 0.76 AAK1 (0.53) FAAHAAK1
SCHEMBL17492068 0.76 AAK1 (0.53) FAAHAAK1
SCHEMBL13197626 0.74 MEN1 (0.44) RAB9AMAPTPOLBLMNASMN1; SMN2
SCHEMBL13197618 0.74 MEN1 (0.44) RAB9AMAPTPOLBLMNASMN1; SMN2

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-20100217009-A1 Process for Preparing Chroman Derivatives BIAL - PORTELA & CA, S.A. (PT) 2010-08-26 US disclosed
WO-2008143540-A1 PROCESS FOR PREPARING CHROMAN DERIVATIVES BIAL-PORTELA & CA, S.A. (PT) 2008-11-27 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-20100217009-A1 Process for Preparing Chroman Derivatives CYP4A22, CYP2F1, CYP2C19 RAB9A 1087/4885MAPT 4853/4885POLB 1373/4885

“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.