SCHEMBL2970265

SCHEMBL2970265

CCNC(=O)C1C2C3CCC(C3)C12

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.36
TSHR P16473 1/20 0.36
FPR2 P25090 1/20 0.35
POLB P06746 1/20 0.35
EPHX1 P07099 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 6/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 1/20 0.34
CYP2C19 P33261 1/20 0.34
BCHE P06276 1/20 0.33
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
GFER P55789 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PRCP P42785 1/20 0.32

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
SCHEMBL13889380 0.79 TAAR1 (0.37) TAAR1TSHRFPR2POLBEPHX1
SCHEMBL13240197 0.77 FPR3 (0.35) TAAR1FPR2POLBKDM4EALDH1A1
SCHEMBL3984200 0.77 FPR3 (0.35) TAAR1FPR2POLBKDM4EALDH1A1
SCHEMBL15540756 0.72 CHRNB2 (0.45) TSHREPHX1KDM4EALDH1A1KMT2A
SCHEMBL2974931 0.71 EPHX1 (0.46) TSHRFPR2POLBEPHX1KDM4E
SCHEMBL13753972 0.71 POLB (0.59) POLBALDH1A1KMT2AMEN1NPC1
SCHEMBL13753931 0.69 POLB (0.73) POLBKDM4EALDH1A1KMT2AMEN1
SCHEMBL1678458 0.69
SCHEMBL6736256 0.69 CHRNB2 (0.47) TSHREPHX1KDM4EALDH1A1KMT2A
SCHEMBL16409155 0.69 KMT2A (0.33) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8487133-B2 Substituted bicyclo [4.1.0] heptane-7-carboxylic acid amides and derivatives thereof as food flavor substances SYMRISE AG (DE) 2013-07-16 US disclosed
US-8487133-B2 Substituted bicyclo [4.1.0] heptane-7-carboxylic acid amides and derivatives thereof as food flavor substances SYMRISE AG (DE) 2013-07-16 US disclosed
US-20100189863-A1 SUBSTITUTED BICYCLO [4.1.0] HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES SYMRISE GMBH & CO.KG (DE) 2010-07-29 US disclosed
US-20100189863-A1 SUBSTITUTED BICYCLO [4.1.0] HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES SYMRISE GMBH & CO.KG (DE) 2010-07-29 US disclosed
EP-2079322-A1 SUBSTITUTED BICYCLOÝ4.1.0¨HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES Symrise GmbH & Co. KG (DE) 2009-07-22 EP disclosed
WO-2008046895-A1 SUBSTITUTED BICYCLO[4.1.0]HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2008-04-24 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-20100189863-A1 SUBSTITUTED BICYCLO [4.1.0] HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES HCAR3, TAS2R1, HCAR1 TAAR1 9/4885TSHR 394/4885FPR2 504/4885

“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.