SCHEMBL2774294

SCHEMBL2774294

O=Cc1ccc(-c2ccc(F)cc2)cc1F

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 1/20 0.44
ERN1 O75460 6/20 0.44
NFE2L2 Q16236 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40
MAP4K4 O95819 1/20 0.40

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
SCHEMBL29828302 0.87 ERN1 (0.46) KIF11ERN1ESR1ESR2
SCHEMBL30740933 0.86 ERN1 (0.46) KIF11ALDH1A1MAPTERN1KDM4E
SCHEMBL1591812 0.86 ERN1 (0.46) KIF11ALDH1A1MAPTERN1KDM4E
SCHEMBL22459322 0.86 KIF11 (0.61) KIF11ERN1NFE2L2KDM4EESR1
SCHEMBL21199864 0.85 ERN1 (0.45) KIF11ERN1ESR1ESR2
SCHEMBL4552823 0.84 TDP1 (0.48) KIF11ALDH1A1MAPTERN1KDM4E
SCHEMBL4897461 0.84 ESR1 (0.51) KIF11ERN1ESR1ESR2MEN1
SCHEMBL96915 0.82 NFE2L2 (0.54) ALDH1A1ERN1NFE2L2KDM4E
SCHEMBL29824365 0.82 NFE2L2 (0.54) ALDH1A1ERN1NFE2L2KDM4E
SCHEMBL2273143 0.81 KIF11 (0.51) KIF11ERN1

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-1590321-B1 ARYL ALKYL CARBAMATE DERIVATIVES PRODUCTION AND USE THEREOF IN THERAPY SANOFI AVENTIS (FR) 2010-04-28 EP disclosed
US-7632850-B2 2-amino-2-oxoethyl 1-(4'-fluoro-1,1'-biphenyl-4-yl)cyclopropylmethylcarbamate and 2-(methylamino)-2-oxoethyl 1-(4'-fluoro-1,1'-biphenyl-4-yl)cyclopropylmethylcarbamate; fatty acid amide (FAAH) hyrdrolase inhibitors; analgesics; neuropathic pain;psychological disorders; anticarcinogenic agents; AIDS SANOFI-AVENTIS (FR) 2009-12-15 US disclosed
US-20060014830-A1 Arylalkylcarbamate derivatives production and use thereof in therapy SANOFI-AVENTIS (FR) 2006-01-19 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-20060014830-A1 Arylalkylcarbamate derivatives production and use thereof in therapy CBR3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C5 KIF11 3279/4885ALDH1A1 2358/4885MAPT 4791/4885

“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.