SCHEMBL2134221

SCHEMBL2134221

CC(C)C(SCCCCCCC(F)F)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
EPHX1 P07099 1/20 0.35
ACE2 Q9BYF1 1/20 0.33
CPB2 Q96IY4 1/20 0.32
GPR84 Q9NQS5 3/20 0.32
FFAR1 O14842 1/20 0.32
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
SCHEMBL2138160 1.00 MAPT (0.38) MAPTEPHX1ACE2CPB2GPR84
SCHEMBL2132708 0.98 MAPT (0.35) MAPTEPHX1ACE2
SCHEMBL2138765 0.90 MAPT (0.38) MAPTEPHX1ACE2CPB2GPR84
SCHEMBL2136920 0.88 MAPT (0.35) MAPTEPHX1ACE2
SCHEMBL2136786 0.85 RNPEP (0.31) MAPT
SCHEMBL2135816 0.83 MAPT (0.36) MAPTEPHX1ACE2GPR84FFAR1
SCHEMBL2135036 0.82 FOLH1 (0.33) MAPTEPHX1
SCHEMBL2135156 0.82 EPHX1 (0.37) EPHX1CPB2
SCHEMBL2138208 0.82 EPHX1 (0.44) MAPTEPHX1ACE2CPB2GPR84
SCHEMBL2137090 0.82 EPHX1 (0.37) EPHX1CPB2

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-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-26 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-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER GRHPR, AKR7A2, FAR1 MAPT 4195/4885EPHX1 2018/4885ACE2 1635/4885

“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.