SCHEMBL20103513

SCHEMBL20103513

COc1ccc(F)c([C@H]2CC[C@@H](CO)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.41
MAPT P10636 1/20 0.39
MTNR1B P49286 1/20 0.38
ESR1 P03372 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
ESR2 Q92731 1/20 0.38
HTR1A P08908 1/20 0.37
SLC6A4 P31645 1/20 0.37

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
SCHEMBL21644868 1.00 FFAR1 (0.51) FFAR1PTGDR2MAPTMTNR1BESR1
SCHEMBL20103517 1.00 FFAR1 (0.51) FFAR1PTGDR2MAPTMTNR1BESR1
SCHEMBL20103540 1.00 FFAR1 (0.51) FFAR1PTGDR2MAPTMTNR1BESR1
SCHEMBL28714410 0.88 FFAR1 (0.44) FFAR1PTGDR2MAPTESR1CYP3A4
SCHEMBL8098541 0.87 FFAR1 (0.46) FFAR1PTGDR2SLC6A4
SCHEMBL24645999 0.85 FFAR1 (0.47) FFAR1PTGDR2MTNR1BHTR1ASLC6A4
SCHEMBL21644922 0.83 FFAR1 (0.45) FFAR1PTGDR2MTNR1B
SCHEMBL21644875 0.83 EPHX2 (0.43) FFAR1
SCHEMBL20103410 0.83 EPHX2 (0.43) FFAR1
SCHEMBL31638753 0.82 PTGDR2 (0.47) FFAR1PTGDR2MAPTESR1CYP3A4

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 3 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
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 FFAR1 16/4885PTGDR2 208/4885MAPT 4508/4885
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes GPR119, GPR65, GPR55 FFAR1 16/4885PTGDR2 208/4885MAPT 4508/4885

“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.