SCHEMBL7638447

SCHEMBL7638447

FC(F)(F)c1ccc(-c2c(P(c3ccccc3)c3ccccc3)cc(C(F)(F)F)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.37
EDNRA P25101 1/20 0.37
CYP2C9 P11712 1/20 0.36
SCN9A Q15858 1/20 0.36
GPR3 P46089 1/20 0.36
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
CES2 O00748 2/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
POLQ O75417 1/20 0.33
KIF11 P52732 2/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TRPV3 Q8NET8 2/20 0.32
AVPR2 P30518 1/20 0.32
GPR27 Q9NS67 1/20 0.32
GAA P10253 2/20 0.31
GLA P06280 1/20 0.31
POLB P06746 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
SCHEMBL4205832 0.88 ALDH1A1 (0.39) CES2POLQKIF11TSHRALDH1A1
SCHEMBL28294522 0.77 KIF11 (0.46) GPR3KIF11TSHRALDH1A1
SCHEMBL6752521 0.75 CYP3A4 (0.35) EDNRBEDNRAGPR3CES2POLQ
SCHEMBL30954769 0.75 ALDH1A1 (0.45) KIF11TSHRALDH1A1GAAKDM4E
SCHEMBL19009982 0.75 ALDH1A1 (0.39) KIF11TSHRALDH1A1MAPTP2RX1
SCHEMBL25060874 0.72 HSP90AA1 (0.43) CYP2C9KIF11TSHRALDH1A1GAA
SCHEMBL29141880 0.72 ALDH1A1 (0.39) GPR3KIF11TSHRALDH1A1GAA
SCHEMBL29141867 0.72 TAS2R14 (0.41) GPR3KIF11TSHRALDH1A1AVPR2
SCHEMBL1043812 0.72 HSD11B1 (0.30)
SCHEMBL31566348 0.72 HSD11B1 (0.30)

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-20020058832-A1 Novel olefination process to itaconate and succinate derivatives PFIZER INC. 2002-05-16 US disclosed
US-5919962-A CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-07-06 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-20020058832-A1 Novel olefination process to itaconate and succinate derivatives HOGA1, HADHA, OGDH EDNRB 4396/4885EDNRA 4346/4885CYP2C9 454/4885

“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.