SCHEMBL4677533

SCHEMBL4677533

CC(C)(C)OC(=O)N1CCC(C2C(=O)Nc3ccccc32)CC1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.55
KDM4E B2RXH2 2/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN6 P29350 1/20 0.46
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 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
SCHEMBL105541 0.86 GPR119 (0.53) GPR119KDM4EMAPTTHRBPKM
SCHEMBL3968317 0.84 TNKS (0.49) GPR119KDM4EMAPTTHRB
SCHEMBL30721792 0.83 GPR119 (0.49) GPR119KDM4EMAPTTHRBPKM
SCHEMBL29151416 0.83 GPR119 (0.49) GPR119KDM4EMAPTTHRBPKM
SCHEMBL4675164 0.81 TNKS (0.43) KDM4EMAPT
SCHEMBL3969511 0.81 TNKS (0.46) GPR119KDM4EMAPTTHRB
SCHEMBL2211837 0.81 GPR119 (0.54) GPR119KDM4EMAPTTHRBPKM
SCHEMBL19570634 0.80 NAMPT (0.41) KDM4EMAPT
SCHEMBL10062680 0.79 CHRM1 (0.54) KDM4EMAPT
SCHEMBL4114147 0.78 MAPT (0.43) GPR119KDM4EMAPTTHRBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190002436-A1 RESPIRATORY SYNCYTIAL VIRUS INHIBITORS MEDIVIR AB (SE) 2019-01-03 US disclosed
EP-1997805-A1 Compounds with antiparasitic activity, applications thereof to the treatment of infectious diseases caused by apicomplexans Commissariat à l'Energie Atomique (FR) 2008-12-03 EP disclosed
WO-1999032481-A1 MUSCARINIC AGENTS AND USE THEREOF TO TREAT GLAUCOMA, MYOPIA AND VARIOUS OTHER CONDITIONS ALCON LABORATORIES, INC. (US) 1999-07-01 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-20190002436-A1 RESPIRATORY SYNCYTIAL VIRUS INHIBITORS NR0B1, NR1I3, SCARB1 GPR119 210/4885KDM4E 3973/4885MAPT 4269/4885

“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.