SCHEMBL4796776

SCHEMBL4796776

COC(=O)C1CC2CCCCC2N1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.40
KMT2A Q03164 5/20 0.40
CYP3A4 P08684 6/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
FABP7 O15540 2/20 0.39
ACE P12821 3/20 0.39
MEN1 O00255 2/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
EPHX2 P34913 1/20 0.38
ALOX15 P16050 1/20 0.37
FFAR2 O15552 1/20 0.37

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
SCHEMBL4799791 0.90 ACE (0.42) FABP5KMT2ACYP3A4ALDH1A1KDM4E
SCHEMBL4799875 0.89 ACE (0.40) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL4798595 0.89 CASP1 (0.43) FABP5KMT2AFABP7ACEMEN1
SCHEMBL4799109 0.89 ACE (0.37) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL30532495 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL22636129 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL28944303 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL4802204 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL29634909 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE
SCHEMBL29779377 0.88 ACE (0.45) FABP5KMT2ACYP3A4FABP7ACE

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
US-7439036-B2 Process for producing optically active octahydro-1H-indole-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-21 US disclosed
EP-1536017-B1 Process for producing optically active octahydro-1H-indole-2-carboxylic acid SUMITOMO CHEMICAL CO (JP) 2007-04-18 EP disclosed
EP-1536017-A2 Process for producing optically active octahydro-1H-indole-2-carboxylic acid Sumitomo Chemical Company, Limited (JP) 2005-06-01 EP disclosed
US-20050106690-A1 Process for producing optically active octahydro-1H-indole-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED 2005-05-19 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-20050106690-A1 Process for producing optically active octahydro-1H-indole-2-carboxylic acid IDO1, IDO2, APEH FABP5 4540/4885KMT2A 1707/4885CYP3A4 365/4885

“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.