SCHEMBL20103281

SCHEMBL20103281

COc1ccc(F)c(C2CCCCC2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.52
FFAR1 O14842 9/20 0.42
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
HTR2A P28223 2/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL8098541 0.91 FFAR1 (0.46) PTGDR2FFAR1HTR2AHTR2CHTR2B
SCHEMBL1515977 0.86 PTGDR2 (0.49) PTGDR2NOS3NOS1NOS2HTR2A
SCHEMBL21644922 0.83 FFAR1 (0.45) PTGDR2FFAR1NOS3NOS1NOS2
SCHEMBL6616630 0.81 PTGDR2 (0.54) PTGDR2NOS3NOS1NOS2MEN1
SCHEMBL30609128 0.80 FFAR4 (0.40) PTGDR2FFAR1
SCHEMBL24645999 0.80 FFAR1 (0.47) PTGDR2FFAR1HTR2A
SCHEMBL21644953 0.80 FFAR1 (0.45) PTGDR2FFAR1
SCHEMBL21644868 0.80 FFAR1 (0.51) PTGDR2FFAR1
SCHEMBL20103540 0.80 FFAR1 (0.51) PTGDR2FFAR1
SCHEMBL20103513 0.80 FFAR1 (0.51) PTGDR2FFAR1

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-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV (BE) 2021-04-27 US disclosed
WO-2020242943-A1 GPR40 AGONISTS KALLYOPE, INC. (US) 2020-12-03 WO disclosed
US-20200039914-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN RESEARCH & DEVELOPMENT, LLC 2020-02-06 US disclosed
WO-2018081047-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO 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 (2 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-20200039914-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES GPR119, GPR65, GPR55 PTGDR2 208/4885FFAR1 16/4885NOS3 2562/4885
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes GPR119, GPR65, GPR55 PTGDR2 208/4885FFAR1 16/4885NOS3 2562/4885

“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.