SCHEMBL1116282

SCHEMBL1116282

CCCCCCCCCCCCCCCCCCCCCCC(C)(CC)CC

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
GGPS1 O95749 6/20 0.41
FDPS P14324 9/20 0.39
SMPD1 P17405 2/20 0.38
CES2 O00748 1/20 0.38
LPAR1 Q92633 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38

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
SCHEMBL10496964 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1116283 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL27997712 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1115963 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1116218 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL11491067 0.97 TSHR (0.41) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL4865538 0.94 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL5574361 0.94 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1116095 0.92 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL1116285 0.92 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8366630-B2 Carbon nanotube structures in sensor apparatuses for analyzing biomarkers in breath samples TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2013-02-05 US disclosed
EP-2281193-B1 CARBON NANOTUBE STRUCTURES IN SENSOR APPARATUSES FOR ANALYZING BIOMARKERS IN BREATH SAMPLES TECHNION RES & DEV FOUNDATION (IL) 2012-08-15 EP disclosed
US-20110098591-A1 CARBON NANOTUBE STRUCTURES IN SENSOR APPARATUSES FOR ANALYZING BIOMARKERS IN BREATH SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2011-04-28 US disclosed
EP-2281193-A1 CARBON NANOTUBE STRUCTURES IN SENSOR APPARATUSES FOR ANALYZING BIOMARKERS IN BREATH SAMPLES Technion Research and Development Foundation, Ltd. (IL) 2011-02-09 EP disclosed
WO-2009144725-A1 CARBON NANOTUBE STRUCTURES IN SENSOR APPARATUSES FOR ANALYZING BIOMARKERS IN BREATH SAMPLES TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2009-12-03 WO disclosed