SCHEMBL697018

SCHEMBL697018

COC(=O)Oc1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.56
ALDH1A1 P00352 1/20 0.47
EPHX2 P34913 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
MAOB P27338 2/20 0.45
CYP1A1 P04798 1/20 0.45
CYP1B1 Q16678 1/20 0.45
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
TRPV1 Q8NER1 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CFTR P13569 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL21991789 0.95 KIF11 (0.51) KIF11ALDH1A1EPHX2CYP11B1CYP11B2
SCHEMBL1720744 0.88 KIF11 (0.63) KIF11ALDH1A1EPHX2CYP11B1CYP11B2
SCHEMBL21991493 0.86 MAOB (0.66) MAOB
SCHEMBL16395041 0.85 ESR1 (0.44) KIF11ALDH1A1TRPV1MEN1KMT2A
SCHEMBL21991236 0.84 KIF11 (0.51) KIF11ALDH1A1CYP11B1CYP11B2MAOB
SCHEMBL676909 0.83 KMT2A (0.58) ALDH1A1CES2CES1MEN1KMT2A
SCHEMBL10706859 0.83 KIF11 (0.54) KIF11ALDH1A1CYP11B1CYP11B2MAOB
SCHEMBL10706875 0.83 KIF11 (0.54) KIF11ALDH1A1CYP11B1CYP11B2PRSS1
SCHEMBL6934422 0.82 ELANE (0.46) ALDH1A1MEN1KMT2ALMNA
SCHEMBL1790162 0.82 MAPT (0.56) ALDH1A1EPHX2PRSS1ACRTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-10940132-B2 CCL5 inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20200138766-A1 CCL5 INHIBITORS LAPKO INC. DBA AFECTA PHARMACEUTICALS 2020-05-07 US disclosed
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-2320732-A2 SUBSTITUTED IMIDAZOLE COMBINATIONS Pfizer Inc. (US) 2011-05-18 EP disclosed
US-7825149-B2 Substituted imidazoles PFIZER LIMITED (GB) 2010-11-02 US disclosed
WO-2010020896-A2 SUBSTITUTED IMIDAZOLE COMBINATIONS PFIZER INC. (US) 2010-02-25 WO disclosed
US-20100041712-A1 SUBSTITUTED IMIDAZOLE COMBINATIONS PFIZER INC. (US) 2010-02-18 US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US disclosed
EP-1981853-A1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES Pfizer Limited (GB) 2008-10-22 EP disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 US disclosed
WO-2007083207-A1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LIMITED (GB) 2007-07-26 WO disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 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 (11 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-20080125473-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KIF11 2852/4885ALDH1A1 617/4885EPHX2 1301/4885
US-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KIF11 2852/4885ALDH1A1 617/4885EPHX2 1301/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KIF11 2852/4885ALDH1A1 617/4885EPHX2 1301/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KIF11 2852/4885ALDH1A1 617/4885EPHX2 1301/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885
US-20100041712-A1 SUBSTITUTED IMIDAZOLE COMBINATIONS ING2, IGFBP2, IGFBP1 KIF11 3988/4885ALDH1A1 2795/4885EPHX2 3528/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 KIF11 4250/4885ALDH1A1 932/4885EPHX2 1344/4885

“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.