SCHEMBL15957656

SCHEMBL15957656

Cc1ccc(C(O)(F)F)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MITF O75030 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ESR1 P03372 2/20 0.38
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
AR P10275 1/20 0.35
ESR2 Q92731 1/20 0.35
MLYCD O95822 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
SLC2A1 P11166 1/20 0.34
KIF11 P52732 1/20 0.34

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
SCHEMBL18155538 0.83 CYP19A1 (0.42) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL15957681 0.81 CYP19A1 (0.41) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL309960 0.81 NR1H2 (0.52) MEN1KMT2ANR1H2NR1H3AR
SCHEMBL12126487 0.79 HSD11B1 (0.47) CYP19A1ESR1
SCHEMBL16626111 0.79 ALDH1A1 (0.42) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL1755260 0.79 PDE2A (0.46) ALDH1A1KIF11
SCHEMBL822330 0.79 ALDH1A1 (0.42) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL11746050 0.78 CYP19A1 (0.42) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL9690838 0.78 CYP19A1 (0.39) CYP19A1MEN1KMT2AMITFALDH1A1
SCHEMBL23592890 0.77 ALDH1A1 (0.40) CYP19A1MEN1KMT2AMITFALDH1A1

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 CYP19A1 1347/4885MEN1 1359/4885KMT2A 326/4885

“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.