SCHEMBL1815579

SCHEMBL1815579

CC(C)(C)OC(=O)N1CCC2(CC1)CC(O[Si](C)(C)C(C)(C)C)c1cc(-c3noc(=O)[nH]3)ccc1O2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.41
GPR119 Q8TDV5 10/20 0.41
SCD5 Q86SK9 2/20 0.37
HRH3 Q9Y5N1 1/20 0.36
RBP4 P02753 1/20 0.36
PKM P14618 1/20 0.35
NAMPT P43490 1/20 0.34

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 1.00 IDO1 (0.41) IDO1GPR119SCD5HRH3RBP4
SCHEMBL733219 0.91 RBP4 (0.35) IDO1GPR119RBP4
SCHEMBL1812127 0.88 IDO1 (0.43) IDO1GPR119SCD5HRH3RBP4
SCHEMBL310131 0.88 IDO1 (0.43) IDO1GPR119SCD5HRH3RBP4
SCHEMBL4276284 0.87 RARB (0.33) RBP4
SCHEMBL1816761 0.80 KMT2A (0.49) GPR119
SCHEMBL309247 0.80 KMT2A (0.49) GPR119
SCHEMBL743373 0.80 IDO1 (0.43) IDO1GPR119HRH3NAMPT
SCHEMBL309181 0.80 IDO1 (0.45) IDO1GPR119
SCHEMBL309180 0.80 IDO1 (0.45) IDO1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910375-B1 SPIROCHROMANONE DERIVATIVES AS ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS MERCK SHARP & DOHME (US) 2011-05-11 EP disclosed
US-7935712-B2 Spirochromanone derivatives as acetyl coenzyme A carboxylase (ACC) inhibitors MERCK SHARP & DOHME CORP. (US) 2011-05-03 US disclosed
US-20090131464-A1 SPIROCHROMANONE DERIVATIVES AS ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS MERCK SHARP & DOHME LLC 2009-05-21 US disclosed
US-7410976-B2 Spirochromanone derivatives MERCK & CO., INC. (US) 2008-08-12 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-20090131464-A1 SPIROCHROMANONE DERIVATIVES AS ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS ACACA, ACACB, ACAT1 IDO1 4750/4885GPR119 1937/4885SCD5 1168/4885

“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.