SCHEMBL20103465

SCHEMBL20103465

COc1ccc(F)c(C2=CCC3(CC2)OCCO3)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.39
SUV39H2 Q9H5I1 2/20 0.39
APP P05067 2/20 0.39
POLB P06746 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
KDM1A O60341 1/20 0.34
CTSD P07339 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
IDH2 P48735 1/20 0.33
MALT1 Q9UDY8 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL22857391 0.90 SUV39H2 (0.39) BACE1SUV39H2APPPOLBALDH1A1
SCHEMBL21688307 0.83 IDH2 (0.34) BACE1APPALDH1A1CNR1CNR2
SCHEMBL22857362 0.83 SUV39H2 (0.46) SUV39H2POLBALDH1A1KDM4EHSD17B10
SCHEMBL16931303 0.82 NPC1 (0.40) SUV39H2KMT2A
SCHEMBL1506457 0.79 SUV39H2 (0.43) SUV39H2POLBALDH1A1KDM4EHSD17B10
SCHEMBL3167077 0.78 SUV39H2 (0.46) SUV39H2POLBALDH1A1KDM4EHSD17B10
SCHEMBL1528269 0.78 SUV39H2 (0.33) SUV39H2
SCHEMBL6635626 0.77 KDM4E (0.58) ALDH1A1KDM4EHSD17B10KMT2A
SCHEMBL20010782 0.76 MAPK14 (0.33) SUV39H2ALDH1A1KDM4EKMT2A
SCHEMBL2915518 0.76 SUV39H2 (0.45) BACE1SUV39H2ALDH1A1KDM4EHSD17B10

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 5 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-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
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 BACE1 2984/4885SUV39H2 3162/4885APP 2432/4885
US-10988433-B2 Cyclohexyl GPR40 agonists for the treatment of type II diabetes GPR119, GPR65, GPR55 BACE1 2984/4885SUV39H2 3162/4885APP 2432/4885

“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.