SCHEMBL10062004

SCHEMBL10062004

CCC(C)C(=O)NC1(C(=O)O)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CNR2 P34972 3/20 0.33
ALDH1A1 P00352 2/20 0.33
CXCR2 P25025 1/20 0.33
FABP4 P15090 3/20 0.33
FABP5 Q01469 3/20 0.33
GLS O94925 1/20 0.33
KDM4E B2RXH2 1/20 0.31
RAB9A P51151 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL10877742 0.84 MME (0.36) MMECNR2ALDH1A1CXCR2FABP4
SCHEMBL11603247 0.84 MME (0.41) MMEKDM4EHSD17B10
SCHEMBL10876885 0.81 CYP1A2 (0.44) MMEALDH1A1CXCR2
SCHEMBL10883519 0.80 CXCR2 (0.33) MMETSHRCNR2ALDH1A1CXCR2
SCHEMBL7229443 0.80 CNR2 (0.33) MMECNR2ALDH1A1CXCR2FABP4
SCHEMBL5101577 0.79 ALDH1A1 (0.36) CNR2ALDH1A1CXCR2FABP4FABP5
SCHEMBL9752273 0.78 CYP1A2 (0.35) ALDH1A1CXCR2FABP4FABP5
SCHEMBL1403838 0.75 PYGL (0.33) CNR2ALDH1A1CXCR2FABP4FABP5
SCHEMBL4416357 0.75 ECE1 (0.45) MMEALDH1A1FABP4FABP5
SCHEMBL1403840 0.75 PYGL (0.33) CNR2ALDH1A1CXCR2FABP4FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106216-B2 Process for the preparation of Irbesartan AUROBINDO PHARMA LTD. (IN) 2012-01-31 US disclosed
US-20100056797-A1 Process for the Preparation of Irbesartan AUROBINDO PHARMA LTD (IN) 2010-03-04 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-20100056797-A1 Process for the Preparation of Irbesartan AGTR1, REN, AGTR2 MME 39/4885MEN1 1645/4885TSHR 781/4885

“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.