SCHEMBL18609604

SCHEMBL18609604

CC(C)(C)OC(=O)N1CCC(Oc2ccc(C(F)(F)F)cc2N)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.53
PDE4D Q08499 3/20 0.52
PDE4B Q07343 3/20 0.52
PDE4A P27815 2/20 0.52
PDE4C Q08493 2/20 0.52
KDM1A O60341 1/20 0.51
STS P08842 1/20 0.47
MAPT P10636 1/20 0.46
TOP2A P11388 1/20 0.44
TGFBR1 P36897 1/20 0.44

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
SCHEMBL4877902 0.94 PDE4B (0.49) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL18615447 0.94 PDE4B (0.49) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL18615672 0.94 PDE4B (0.49) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL18615745 0.89 PDE4B (0.45) GPR119PDE4DPDE4BMAPT
SCHEMBL28532412 0.89 GPR119 (0.55) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL22462754 0.87 GPR119 (0.58) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL20569833 0.87 GPR119 (0.53) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL275404 0.85 GPR119 (0.52) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL29716374 0.84 GPR119 (0.56) GPR119PDE4DPDE4BPDE4APDE4C
SCHEMBL358194 0.84 PDE4B (0.53) GPR119PDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3345893-B1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES (JP) 2019-10-30 EP disclosed
EP-3345893-B1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES (JP) 2019-10-30 EP disclosed
US-10280145-B2 Urea derivative and use therefor TORAY INDUSTRIES, INC. (JP) 2019-05-07 US disclosed
US-10280145-B2 Urea derivative and use therefor TORAY INDUSTRIES, INC. (JP) 2019-05-07 US disclosed
US-20190010117-A1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES, INC. (JP) 2019-01-10 US disclosed
US-20180237398-A1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES, INC. (JP) 2018-08-23 US disclosed
EP-3345893-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 EP disclosed
EP-3345893-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 EP disclosed
EP-3345892-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 EP disclosed
EP-3345892-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 EP disclosed
WO-2017038871-A1 UREA DERIVATIVE AND USE THEREFOR 東レ株式会社 2017-03-09 WO disclosed
WO-2017038873-A1 UREA DERIVATIVE AND USE THEREFOR 東レ株式会社 2017-03-09 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 (3 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-10280145-B2 Urea derivative and use therefor UTS2R, DDR1, WEE1 GPR119 183/4885PDE4D 1251/4885PDE4B 1389/4885
US-20190010117-A1 UREA DERIVATIVE AND USE THEREFOR UTS2R, SLC14A1, TMEM164 GPR119 149/4885PDE4D 657/4885PDE4B 729/4885
US-20180237398-A1 UREA DERIVATIVE AND USE THEREFOR UTS2R, DDR1, WEE1 GPR119 183/4885PDE4D 1251/4885PDE4B 1389/4885

“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.