SCHEMBL2080702

SCHEMBL2080702

CC(C)(O)CC1CCC(O)CN1C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
NR1H2 P55055 1/20 0.36
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL30743015 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2913001 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL21598852 0.85 CHRM2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL17812945 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL27308664 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2913004 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2913008 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2078104 0.84 NR1H2 (0.35) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2078108 0.84 NR1H2 (0.35) CHRM2CHRM1CHRM3CYP1A2POLB
SCHEMBL2078105 0.84 NR1H2 (0.35) CHRM2CHRM1CHRM3CYP1A2POLB

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-7906532-B2 Antiserotonine agents; gastrointestinal disorders; irritable bowel syndrome; central nervous system disorders; Alzheimer's disease; cognition activators; analgesics; cardiovascular disorders; antidiabetic agents; sleep disorders PFIZER INC. (US) 2011-03-15 US disclosed
EP-1910340-B1 INDAZOLECARBOXAMIDE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER (US) 2009-11-18 EP disclosed
US-20080269211-A1 Indazole Derivatives PFIZER INC 2008-10-30 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 (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-20080269211-A1 Indazole Derivatives GPR119, HRH4, HTR4 CHRM2 14/4885CHRM1 8/4885CHRM3 17/4885

“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.