SCHEMBL4800296

SCHEMBL4800296

COC(=O)C1CC2CCCCC2N1C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.52
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 2/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 2/20 0.45
KDM4E B2RXH2 1/20 0.45
PREP P48147 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MMP2 P08253 1/20 0.43

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
SCHEMBL4798814 0.87 FFAR2 (0.47) FFAR2KMT2AMEN1PREP
SCHEMBL4800001 0.86 FFAR2 (0.47) FFAR2KMT2AMEN1PREP
SCHEMBL4800187 0.86 ACE (0.48) FFAR2KMT2AALDH1A1MEN1CYP3A4
SCHEMBL4799439 0.85 FFAR2 (0.54) FFAR2KMT2AMEN1PREP
SCHEMBL10722960 0.85 FFAR2 (0.54) FFAR2KMT2AMEN1PREP
SCHEMBL4798679 0.84 FFAR2 (0.45) FFAR2KMT2AALDH1A1MEN1CYP3A4
SCHEMBL4800042 0.83 FFAR2 (0.44) FFAR2KMT2AMEN1CYP3A4PREP
SCHEMBL8307399 0.83 KMT2A (0.57) KMT2AALDH1A1MEN1POLBCYP3A4
SCHEMBL8307395 0.83 KMT2A (0.57) KMT2AALDH1A1MEN1POLBCYP3A4
SCHEMBL8307397 0.83 KMT2A (0.57) KMT2AALDH1A1MEN1POLBCYP3A4

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 FFAR2 355/4885KMT2A 1707/4885ALDH1A1 148/4885

“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.