SCHEMBL6466375

SCHEMBL6466375

FC(F)C(F)Oc1ccc(OC(F)C(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.37
ALDH1A1 P00352 2/20 0.35
ATM Q13315 2/20 0.35
ALOX15 P16050 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
CCR6 P51684 1/20 0.35
GFER P55789 1/20 0.35
ADAM17 P78536 1/20 0.35
ALDH1A3 P47895 1/20 0.31
SLC6A4 P31645 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
LDHA P00338 1/20 0.30

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
SCHEMBL3732313 0.87 MEN1 (0.46) ALDH1A1ALOX15KMT2AMEN1LMNA
SCHEMBL10602962 0.87 PPARG (0.39) KMT2AMEN1LMNASLC6A4
SCHEMBL28384768 0.87 LDHA (0.47) DRD1ALDH1A1ALOX15KMT2AMEN1
SCHEMBL2970016 0.86 LTA4H (0.41) ALDH1A1ALOX15KMT2AMEN1LMNA
SCHEMBL29153373 0.82 LMNA (0.33) ALDH1A1KMT2AMEN1LMNASLC6A4
SCHEMBL17134135 0.82
SCHEMBL28895840 0.82 GAA (0.44) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL1414596 0.82 DRD1 (0.63) DRD1ALDH1A1KMT2ALMNAHPGD
SCHEMBL8129120 0.82 CA2 (0.48)
SCHEMBL6640503 0.82 TRPA1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1125344-A None JP disclosed
US-6849762-B2 Process for preparing a trifluoroethoxy-substituted benzoic acid MERCK PATENT GMBH (DE) 2005-02-01 US disclosed
US-20030176721-A1 Method for the production of trifluoroethoxy-substituted benzoic acids MERCK PATENT GMBH (DE) 2003-09-18 US disclosed
JP-H01125344-A PRODUCTION OF 2,5-BIS(2,2,2-TRIFLUOROETHOXY)BENZOIC ACID RIKER LAB INC 1989-05-17 JP 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-20030176721-A1 Method for the production of trifluoroethoxy-substituted benzoic acids NISCH, TBCA, TALDO1 DRD1 3037/4885ALDH1A1 298/4885ATM 4392/4885

“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.