SCHEMBL4799995

SCHEMBL4799995

CCC(C)OC(=O)C1CC2CCCCC2N1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 2/20 0.38
ALOX15 P16050 1/20 0.38
FABP5 Q01469 3/20 0.35
FABP7 O15540 2/20 0.35
DPP4 P27487 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
PREP P48147 2/20 0.33

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
SCHEMBL4799875 0.92 ACE (0.40) ACEKMT2AMEN1USP2LMNA
SCHEMBL4799791 0.87 ACE (0.42) ACEKMT2AMEN1USP2LMNA
SCHEMBL4801231 0.86 ACE (0.39) ACEKMT2AMEN1USP2LMNA
SCHEMBL4796776 0.86 FABP5 (0.40) ACEKMT2AMEN1USP2LMNA
SCHEMBL4799109 0.85 ACE (0.37) ACEKMT2AMEN1USP2LMNA
SCHEMBL4798802 0.83 SMN1; SMN2 (0.38) ACEKMT2AMEN1USP2LMNA
SCHEMBL4800041 0.83 ACE (0.47) ACEKMT2AMEN1USP2LMNA
SCHEMBL4798595 0.83 CASP1 (0.43) ACEKMT2AMEN1USP2LMNA
SCHEMBL4802204 0.82 ACE (0.45) ACEKMT2AMEN1USP2LMNA
SCHEMBL30532495 0.82 ACE (0.45) ACEKMT2AMEN1USP2LMNA

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 ACE 1148/4885KMT2A 1707/4885MEN1 1912/4885

“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.