SCHEMBL3519671

SCHEMBL3519671

CC(C)(C)OC(=O)N1C2CCC1CC(OCc1c(F)cccc1-c1ccccc1)C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 3/20 0.42
▸ CHRM1 P11229 3/20 0.42
▸ CHRM3 P20309 3/20 0.42
▸ GPR119 Q8TDV5 8/20 0.39
▸ UCHL1 P09936 1/20 0.37
▸ BTK Q06187 1/20 0.36
▸ ABCB1 P08183 1/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ RORC P51449 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ AGTR2 P50052 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CHRM5 P08912 1/20 0.35
▸ ADRA2C P18825 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ ADRA1A P35348 1/20 0.35

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
SCHEMBL3519667 1.00 CHRM2 (0.42) CHRM2CHRM1CHRM3GPR119UCHL1
SCHEMBL3520014 0.92 GPR119 (0.44) CHRM2CHRM1CHRM3GPR119BTK
SCHEMBL3520011 0.92 GPR119 (0.44) CHRM2CHRM1CHRM3GPR119BTK
SCHEMBL12012206 0.90 CHRM2 (0.49) CHRM2CHRM1CHRM3GPR119RORC
SCHEMBL3520227 0.86 CHRM2 (0.45) CHRM2CHRM1CHRM3GPR119HSD11B1
SCHEMBL3520222 0.86 CHRM2 (0.45) CHRM2CHRM1CHRM3GPR119HSD11B1
SCHEMBL3520871 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3GPR119UCHL1
SCHEMBL3520875 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3GPR119UCHL1
SCHEMBL3517524 0.83 GPR119 (0.41) CHRM2CHRM1CHRM3GPR119BTK
SCHEMBL3517523 0.83 GPR119 (0.41) CHRM2CHRM1CHRM3GPR119BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8252810-B2 Bicycloamine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-28 — — US disclosed
US-8252810-B2 Bicycloamine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-28 — — US disclosed
US-8252810-B2 Bicycloamine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-08-28 — — US disclosed
US-20100331310-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-30 — — US disclosed
US-20100331310-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-30 — — US disclosed
US-20100331310-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-30 — — US disclosed
EP-2241567-A1 BICYCLOAMINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-10-20 — — EP disclosed
EP-2241567-A1 BICYCLOAMINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-10-20 — — EP disclosed
US-20090270369-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-10-29 — — US disclosed
US-20090270369-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-10-29 — — US disclosed
US-20090270369-A1 BICYCLOAMINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-10-29 — — 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 (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-20100331310-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 CHRM2 149/4885CHRM1 135/4885CHRM3 315/4885
US-20090270369-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 CHRM2 149/4885CHRM1 135/4885CHRM3 315/4885

“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.

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