SCHEMBL3754064

SCHEMBL3754064

[CH2]Oc1ccc(Cl)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.45
PPARA Q07869 6/20 0.45
SLC6A4 P31645 4/20 0.42
SLC6A2 P23975 4/20 0.42
SLC6A3 Q01959 3/20 0.42
KCNH2 Q12809 1/20 0.42
USP30 Q70CQ3 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.40
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
S1PR4 O95977 1/20 0.37
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
TTR P02766 1/20 0.35
PGR P06401 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
HSPA5 P11021 1/20 0.35

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
SCHEMBL1765256 0.77 LMNA (0.50) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL1547178 0.76 CES2 (0.43) ALDH1A1
SCHEMBL290801 0.76 TTR (0.52) SLC6A2SLC6A3S1PR4MAPTHPGD
SCHEMBL1023561 0.76 LMNA (0.48) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL1174046 0.76 PPARG (0.44) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL24252062 0.74 SLC6A4 (0.44) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL8396955 0.74 EPHX2 (0.50) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL2252284 0.74 MRGPRX4 (0.48) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL5317553 0.74 S1PR4 (0.48) PPARGPPARASLC6A4SLC6A2SLC6A3
SCHEMBL1044895 0.73 MAPK1 (0.43) SLC6A4MAPTHPGDLMNAKDM4E

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-8426631-B2 Fungicidal compounds, method for the production thereof, and use thereof to combat damaging fungi, and agents comprising the same BASF SE (DE) 2013-04-23 US disclosed
US-20100304966-A1 Fungicidal Compounds, Method For the Production Thereof, And Use Thereof To Combat Damaging Fungi, And Agents Comprising The Same BASF SE (DE) 2010-12-02 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-20100304966-A1 Fungicidal Compounds, Method For the Production Thereof, And Use Thereof To Combat Damaging Fungi, And Agents Comprising The Same CYP51A1, ERG28, CAT PPARG 3237/4885PPARA 2378/4885SLC6A4 4503/4885

“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.