SCHEMBL17003306

SCHEMBL17003306

Cc1cc(C)cc(-c2ccc([Si](C)(C)C)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
CNR2 P34972 1/20 0.37
SCN5A Q14524 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
NOTUM Q6P988 1/20 0.34
ALDH1A1 P00352 3/20 0.34
ENPP3 O14638 2/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PDPK1 O15530 1/20 0.33
APP P05067 1/20 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
SCHEMBL14999152 0.95 RXRA (0.42) RXRARXRBCNR2SCN5ANPC1
SCHEMBL14553136 0.85 ESR1 (0.41) SCN5ANPC1RAB9ANR1H2NR1H3
SCHEMBL13664879 0.82 ENPP3 (0.45) SCN5ANPC1RAB9ANR1H2NR1H3
SCHEMBL12367284 0.82 ENPP3 (0.45) SCN5ANPC1RAB9ANR1H2NR1H3
SCHEMBL10997473 0.82 NR1H2 (0.44) SCN5ANR1H2NR1H3ALDH1A1ENPP3
SCHEMBL28308652 0.82 NR1H2 (0.44) SCN5ANR1H2NR1H3ALDH1A1ENPP3
SCHEMBL20022141 0.81 ENPP3 (0.51) NPC1RAB9ANOTUMALDH1A1ENPP3
SCHEMBL16802048 0.80 ENPP3 (0.54) NPC1RAB9ANOTUMALDH1A1ENPP3
SCHEMBL12816149 0.79 RXRA (0.45) RXRARXRBCNR2NPC1RAB9A
SCHEMBL25763105 0.79 SCN5A (0.35) SCN5ARAB9ANR1H2NR1H3NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3105202-B1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2024-11-13 EP disclosed
CN-106103392-B Graphene nanoribbons with controlled zig-zag edge and curved edge configurations 巴斯夫欧洲公司 2020-06-26 CN disclosed
US-10329378-B2 Graphene nanoribbons with controlled zig-zag edge and cove edge configuration BASF SE (DE) 2019-06-25 US disclosed
US-10329378-B2 Graphene nanoribbons with controlled zig-zag edge and cove edge configuration BASF SE (DE) 2019-06-25 US disclosed
US-20170051101-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2017-02-23 US disclosed
US-20170051101-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2017-02-23 US disclosed
US-20170051101-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2017-02-23 US disclosed
EP-3105202-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2016-12-21 EP disclosed
WO-2015121785-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2015-08-20 WO disclosed
WO-2015121785-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION BASF SE (DE) 2015-08-20 WO disclosed
EP-2907791-A1 Graphene nanoribbons with controlled zig-zag edge and cove edge configuration BASF SE (DE) 2015-08-19 EP disclosed
EP-2907791-A1 Graphene nanoribbons with controlled zig-zag edge and cove edge configuration BASF SE (DE) 2015-08-19 EP 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 (2 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-20170051101-A1 GRAPHENE NANORIBBONS WITH CONTROLLED ZIG-ZAG EDGE AND COVE EDGE CONFIGURATION ZC3HAV1L, ZC3HAV1, ZYX RXRA 2776/4885RXRB 2503/4885CNR2 4494/4885
US-10329378-B2 Graphene nanoribbons with controlled zig-zag edge and cove edge configuration ZC3HAV1L, ZC3HAV1, ZYX RXRA 2776/4885RXRB 2503/4885CNR2 4494/4885

“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.