SCHEMBL15723766

SCHEMBL15723766

CC(C)n1cc(C(F)F)c(C(F)(F)F)n1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.38
ACHE P22303 2/20 0.33
CYP1A2 P05177 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL17452764 0.87 LRRK2 (0.39) LRRK2ACHECYP1A2IRAK4
SCHEMBL20229809 0.81 LRRK2 (0.36) LRRK2ACHECYP1A2
SCHEMBL15730588 0.77 GAA (0.38) CYP1A2
SCHEMBL17454480 0.77 LRRK2 (0.39) LRRK2ACHECYP1A2IRAK4
SCHEMBL21737446 0.77 LRRK2 (0.39) LRRK2ACHECYP1A2IRAK4
SCHEMBL18049567 0.76 LRRK2 (0.39) LRRK2ACHECYP1A2IRAK4
SCHEMBL15723801 0.76 LRRK2 (0.39) LRRK2ACHECYP1A2IRAK4
SCHEMBL20642365 0.74 ACHE (0.33) LRRK2ACHE
SCHEMBL24238830 0.74 LRRK2 (0.38) LRRK2ACHECYP1A2IRAK4
SCHEMBL15723735 0.73 NTRK1 (0.37) LRRK2ACHECYP1A2IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 US disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 US disclosed
US-10370358-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2019-08-06 US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 US disclosed
US-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 US disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 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 (6 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-10370358-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885
US-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885
US-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN LRRK2 1138/4885ACHE 3996/4885CYP1A2 489/4885

“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.