SCHEMBL3522981

SCHEMBL3522981

CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@@H](NCC(=O)c1ccccc1F)C2

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.45
CHRM2 P08172 1/20 0.45
CHRM3 P20309 1/20 0.45
GPR119 Q8TDV5 9/20 0.43
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
GAA P10253 1/20 0.41
PTPN1 P18031 1/20 0.40
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL3522986 1.00 CHRM1 (0.45) CHRM1CHRM2CHRM3GPR119CHRM4
SCHEMBL3519589 0.84 CHRM2 (0.48) CHRM1CHRM2CHRM3GPR119PTPN1
SCHEMBL3537378 0.84 GAA (0.55) CHRM1CHRM2CHRM3GPR119CHRM5
SCHEMBL3537373 0.84 GAA (0.55) CHRM1CHRM2CHRM3GPR119CHRM5
SCHEMBL3519594 0.84 CHRM2 (0.48) CHRM1CHRM2CHRM3GPR119PTPN1
SCHEMBL3604680 0.78 CHRM1 (0.51) CHRM1CHRM2CHRM3GPR119CHRM4
SCHEMBL21794034 0.78 CHRM1 (0.51) CHRM1CHRM2CHRM3GPR119CHRM4
SCHEMBL10077625 0.78 CHRM1 (0.51) CHRM1CHRM2CHRM3GPR119CHRM4
SCHEMBL3069424 0.78 CHRM1 (0.51) CHRM1CHRM2CHRM3GPR119CHRM4
SCHEMBL3522984 0.76 CHRM2 (0.47) CHRM1CHRM2CHRM3GPR119KMT2A

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 4 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-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
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 CHRM1 135/4885CHRM2 149/4885CHRM3 315/4885
US-20090270369-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 CHRM1 135/4885CHRM2 149/4885CHRM3 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.