SCHEMBL3788083

SCHEMBL3788083

CC(C)(C)OC(=O)N1CCC(c2ccccc2F)C(O)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.48
USP30 Q70CQ3 4/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TACR1 P25103 1/20 0.44
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
BRD4 O60885 1/20 0.42
RORC P51449 1/20 0.42

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
SCHEMBL529014 0.87 GPR119 (0.49) GPR119USP30MEN1KMT2ATACR1
SCHEMBL3062560 0.87 GPR119 (0.48) GPR119USP30TACR1JAK2JAK1
SCHEMBL23982326 0.86 TACR1 (0.49) GPR119USP30MEN1KMT2ATACR1
SCHEMBL30119908 0.84 USP30 (0.50) GPR119USP30TACR1JAK2
SCHEMBL30119937 0.84 USP30 (0.50) GPR119USP30TACR1JAK2
SCHEMBL29196994 0.84 USP30 (0.50) GPR119USP30TACR1JAK2
SCHEMBL407256 0.83 GPR119 (0.54) GPR119USP30TACR1JAK2JAK1
SCHEMBL2242108 0.83 GPR119 (0.54) GPR119USP30TACR1JAK2JAK1
SCHEMBL2246047 0.83 GPR119 (0.54) GPR119USP30TACR1JAK2JAK1
SCHEMBL23780218 0.82 GPR119 (0.45) GPR119USP30KMT2AJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections GENELABS TECHNOLOGIES, INC. 2010-08-12 US disclosed
US-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections GENELABS TECHNOLOGIES, INC. 2010-08-12 US disclosed
US-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections GENELABS TECHNOLOGIES, INC. 2010-08-12 US disclosed
WO-2010091409-A1 CERTAIN NITROGEN CONTAINING BICYCLIC CHEMICAL ENTITIES FOR TREATING VIRAL INFECTIONS GLAXOSMITHKLINE LLC (US) 2010-08-12 WO disclosed
WO-2010091409-A1 CERTAIN NITROGEN CONTAINING BICYCLIC CHEMICAL ENTITIES FOR TREATING VIRAL INFECTIONS GLAXOSMITHKLINE LLC (US) 2010-08-12 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 (1 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-20100204265-A1 Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections OAT, HAVCR2, CPS1 GPR119 3009/4885USP30 3131/4885MEN1 4257/4885

“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.