SCHEMBL14192011

SCHEMBL14192011

COc1ncc(C2CC2)cc1CO

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
CFTR P13569 3/20 0.38
DHODH Q02127 1/20 0.37
PDE5A O76074 2/20 0.37
SSTR4 P31391 1/20 0.36
KDM4E B2RXH2 1/20 0.36
FPR2 P25090 2/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
DPP4 P27487 1/20 0.33
HDAC4 P56524 2/20 0.32
SUV39H2 Q9H5I1 1/20 0.32
KDM1A O60341 2/20 0.32

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
SCHEMBL14192007 0.84 PDGFRB (0.40) SSTR5PDGFRBPDGFRACFTRDHODH
SCHEMBL25343383 0.83 HTR2A (0.44)
SCHEMBL20789989 0.78 PDGFRB (0.44) SSTR5PDGFRBPDGFRACFTRSSTR4
SCHEMBL29127205 0.76 KDM4E (0.39) PDGFRBPDGFRAKDM4E
SCHEMBL16877079 0.76 PDGFRB (0.44) SSTR5PDGFRBPDGFRADHODHSSTR4
SCHEMBL25650433 0.75 PDE4D (0.34) PDE5AKDM4EPDE4APDE4BPDE4C
SCHEMBL20789999 0.75 PDGFRB (0.42) SSTR5PDGFRBPDGFRACFTRPDE5A
SCHEMBL21356631 0.75 KDM4E (0.38) KDM4E
SCHEMBL29792909 0.75 KDM4E (0.38) KDM4E
SCHEMBL17071870 0.75 PDGFRB (0.43) PDGFRBPDGFRADHODHPDE5ASSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523277-B1 SUBSTITUTED PYRROLIDINES AS CFTR MODULATORS ABBVIE OVERSEAS SARL (LU) 2021-06-30 EP disclosed
US-20190315687-A1 Substituted Pyrrolidines and Methods of Use ABBVIE S.Á.R.L. (LU) 2019-10-17 US disclosed
US-10399940-B2 Substituted pyrrolidines and methods of use ABBVIE S.Á.R.L. (LU) 2019-09-03 US disclosed
EP-3523277-A1 SUBSTITUTED PYRROLIDINES AS CFTR MODULATORS Abbvie S.a.r.l. (LU) 2019-08-14 EP disclosed
US-20180099932-A1 Substituted Pyrrolidines and Methods of Use GALAPAGOS NV (BE) 2018-04-12 US disclosed
WO-2018065921-A1 SUBSTITUTED PYRROLIDINES AS CFTR MODULATORS ABBVIE S.Á.R.L. (LU) 2018-04-12 WO disclosed
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators MERCK & CO., INC. (US) 2008-05-29 US disclosed
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators MERCK & CO., INC. (US) 2008-05-29 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 (4 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-20190315687-A1 Substituted Pyrrolidines and Methods of Use CFTR, PKD1, PKD2 SSTR5 610/4885PDGFRB 110/4885PDGFRA 21/4885
US-20080124402-A1 N-(Pyridin-3-Yl)-2-Phenylbutanamides As Androgen Receptor Modulators SHBG, AR, NR5A1 SSTR5 2730/4885PDGFRB 258/4885PDGFRA 981/4885
US-10399940-B2 Substituted pyrrolidines and methods of use CFTR, PKD1, PKD2 SSTR5 610/4885PDGFRB 110/4885PDGFRA 21/4885
US-20180099932-A1 Substituted Pyrrolidines and Methods of Use CFTR, PKD1, PKD2 SSTR5 610/4885PDGFRB 110/4885PDGFRA 21/4885

“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.