SCHEMBL4244259

SCHEMBL4244259

CC(=O)NC1(CC(=O)O)Cc2ccccc2C1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.41
HDAC9 Q9UKV0 1/20 0.39
POLB P06746 1/20 0.38
MMP8 P22894 1/20 0.37
TSHR P16473 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CXCR5 P32302 4/20 0.36

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
SCHEMBL8590562 0.84 MME (0.39) MMEHDAC9POLBMMP8CXCR5
SCHEMBL20738515 0.83 MME (0.48) MMEHDAC9POLBMMP8CXCR5
SCHEMBL4815892 0.79 GHSR (0.45) MME
SCHEMBL21916128 0.74 MME (0.47) MMEHDAC9POLBMMP8TSHR
SCHEMBL14037744 0.73 HDAC9 (0.41) HDAC9POLBNAPRTHSD17B10CXCR5
SCHEMBL25787157 0.73 TSHR (0.44) MMEHDAC9POLBMMP8TSHR
SCHEMBL21916449 0.72 ALDH1A1 (0.39) MMEHDAC9MMP8
SCHEMBL4239525 0.71 MME (0.44) MMEHDAC9MMP8
SCHEMBL3373260 0.71 CYP2C19 (0.42) MMETSHR
SCHEMBL7617895 0.70 MME (0.41) MMEHDAC9MMP8TSHRCXCR5

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-20090093473-A1 Spiro-benzimidazoles as inhibitors of gastric acid secretion NYCOMED GMBH (DE) 2009-04-09 US disclosed
EP-1899338-A1 SPIRO-BENZIMIDAZOLES AS INHIBITORS OF GASTRIC ACID SECRETION Nycomed GmbH (DE) 2008-03-19 EP disclosed
EP-1899341-A1 SPIRO-IMIDAZNAPHTHYRIDINE DERIVATIVES AS GASTRIC ACID SECRETION INHIBITORS Nycomed GmbH (DE) 2008-03-19 EP disclosed
WO-2006134111-A1 SPIRO-BENZIMIDAZOLES AS INHIBITORS OF GASTRIC ACID SECRETION NYCOMED GMBH (DE) 2006-12-21 WO disclosed
WO-2006134112-A1 SPIRO-IMIDAZNAPHTHYRIDINE DERIVATIVES AS GASTRIC ACID SECRETION INHIBITORS NYCOMED GMBH (DE) 2006-12-21 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-20090093473-A1 Spiro-benzimidazoles as inhibitors of gastric acid secretion GIPR, PGC, SLC10A2 MME 2311/4885HDAC9 462/4885POLB 4422/4885

“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.