SCHEMBL3537378

SCHEMBL3537378

CC(C)(C)OC(=O)N1C2CCC1CC(NC(=O)c1ccccc1F)C2

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.55
NR1H2 P55055 1/20 0.51
CHRM1 P11229 6/20 0.48
CHRM2 P08172 2/20 0.48
CHRM3 P20309 1/20 0.48
GPR119 Q8TDV5 5/20 0.45
LIPE Q05469 1/20 0.45
USP2 O75604 1/20 0.44
CHRM5 P08912 1/20 0.44
NPC1 O15118 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL3537373 1.00 GAA (0.55) GAANR1H2CHRM1CHRM2CHRM3
SCHEMBL3522986 0.84 CHRM1 (0.45) GAACHRM1CHRM2CHRM3GPR119
SCHEMBL3522981 0.84 CHRM1 (0.45) GAACHRM1CHRM2CHRM3GPR119
SCHEMBL29242230 0.81 USP30 (0.55) GAANR1H2NPC1
SCHEMBL3533984 0.80 GAA (0.68) GAAKMT2A
SCHEMBL3519594 0.80 CHRM2 (0.48) CHRM1CHRM2CHRM3GPR119
SCHEMBL3519589 0.80 CHRM2 (0.48) CHRM1CHRM2CHRM3GPR119
SCHEMBL22083469 0.79 KAT2B (0.41) NR1H2CHRM1CHRM2CHRM3GPR119
SCHEMBL3522984 0.79 CHRM2 (0.47) CHRM1CHRM2CHRM3GPR119KMT2A
SCHEMBL6064154 0.77 CHRM1 (0.43) CHRM1CHRM2CHRM3GPR119

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 10 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
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 GAA 4207/4885NR1H2 2071/4885CHRM1 135/4885
US-20090270369-A1 BICYCLOAMINE DERIVATIVES SCN1B, KCNJ2, KCNH2 GAA 4207/4885NR1H2 2071/4885CHRM1 135/4885

“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.