SCHEMBL15957693

SCHEMBL15957693

Cc1cc(C(O)(C(F)(F)F)C(F)(F)F)cc(C)c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
ACHE P22303 1/20 0.42
PGR P06401 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
AR P10275 2/20 0.39
NR1H3 Q13133 5/20 0.38
NR1H2 P55055 4/20 0.38
MLYCD O95822 3/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37

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
SCHEMBL3140737 0.82 CYP3A4 (0.44) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1
SCHEMBL18896446 0.82 CYP3A4 (0.44) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1
SCHEMBL422352 0.81 RXRA (0.51) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1
SCHEMBL3431607 0.77 SMN1; SMN2 (0.46) PGRSMN1; SMN2ALDH1A1MAPK1AR
SCHEMBL25207237 0.77 CYP3A4 (0.47) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1
SCHEMBL4642911 0.76 CYP3A4 (0.50) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1
SCHEMBL11278793 0.76 SMN1; SMN2 (0.47) PGRSMN1; SMN2MAPK1NR1H3NR1H2
SCHEMBL1333906 0.75 LCK (0.43) SMN1; SMN2ALDH1A1MAPK1NR1H3NR1H2
SCHEMBL14593293 0.75 CES2 (0.45) SMN1; SMN2ALDH1A1MAPK1NR1H3NR1H2
SCHEMBL13199329 0.74 CYP3A4 (0.41) CYP3A4ACHESMN1; SMN2ALDH1A1MAPK1

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
US-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 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-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom MCCC2, AFF2, F13A1 CYP3A4 2766/4885ACHE 4054/4885PGR 4884/4885

“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.