SCHEMBL733219

SCHEMBL733219

CC(C)(C)[Si](C)(C)OC1CC2(CCN(C(=O)O)CC2)Oc2ccc(-c3noc(=O)[nH]3)cc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.35
DPP4 P27487 1/20 0.34
KCNH2 Q12809 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PLA2G2A P14555 3/20 0.33
RARA P10276 1/20 0.33
DGAT1 O75907 1/20 0.33
IDO1 P14902 4/20 0.32
CPT1A P50416 1/20 0.32
CPT1B Q92523 1/20 0.32
RARB P10826 2/20 0.32
RARG P13631 1/20 0.32
HRH1 P35367 1/20 0.32
CCR3 P51677 1/20 0.32
GPR119 Q8TDV5 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL309170 0.91 IDO1 (0.41) RBP4IDO1GPR119
SCHEMBL1815579 0.91 IDO1 (0.41) RBP4IDO1GPR119
SCHEMBL4276284 0.89 RARB (0.33) RBP4PLA2G2ARARARARBRARG
SCHEMBL731730 0.83 HDAC3 (0.39) RBP4DPP4KCNH2DPP7PLA2G2A
SCHEMBL732818 0.78 IDO1 (0.43) KCNH2IDO1
SCHEMBL1812127 0.78 IDO1 (0.43) RBP4IDO1GPR119
SCHEMBL310131 0.78 IDO1 (0.43) RBP4IDO1GPR119
SCHEMBL732811 0.76 IDO1 (0.35) IDO1GPR119
SCHEMBL732812 0.76 IDO1 (0.35) IDO1GPR119
SCHEMBL731276 0.75 EPHX2 (0.46)

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
EP-2120569-B1 SPIROCHROMANON DERIVATIVES MERCK SHARP & DOHME (US) 2013-08-14 EP disclosed
US-8138197-B2 Spirochromanon derivatives MSD K.K. (JP) 2012-03-20 US disclosed
US-20090270436-A1 SPIROCHROMANON DERIVATIVES MERCK SHARP & DOHME LLC 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 (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-20090270436-A1 SPIROCHROMANON DERIVATIVES AKR1C3, CBR3, AKR1C4 RBP4 2173/4885DPP4 4019/4885KCNH2 388/4885

“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.