SCHEMBL964161

SCHEMBL964161

CCCC[Sn](CCCC)(CCCC)c1ccccc1C(=O)NN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
HTT P42858 1/20 0.46
CTSD P07339 2/20 0.45
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
HPGD P15428 2/20 0.41
ALDH1A1 P00352 3/20 0.41
P2RX7 Q99572 1/20 0.41
NAAA Q02083 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 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
SCHEMBL960266 0.94 NAAA (0.44) TSHRHTTCTSDCA1CA2
SCHEMBL1839511 0.82 TSHR (0.47) TSHRHTTCA9HPGDALDH1A1
SCHEMBL4766593 0.79 GABRA1 (0.40) TSHRHTTHPGDALDH1A1TDP1
SCHEMBL961091 0.76 CTSD (0.53) TSHRHTTCTSDCA1CA2
Hydrochloric Acid SCHEMBL6692325 0.73 CTSD (0.61) TSHRHTTCTSDCA1CA2
SCHEMBL4054015 0.72 HTT (0.50) TSHRHTTCTSDCA1CA2
Acetic Acid SCHEMBL27741391 0.72 CTSD (0.60) TSHRHTTCTSDCA1CA2
SCHEMBL961840 0.71 MAPT (0.47) CA1CA2CA9ALDH1A1HDAC3
SCHEMBL1545821 0.71 HTT (0.49) TSHRHTTCTSDCA1CA2
SCHEMBL239328 0.71 CTSD (0.63) TSHRHTTCTSDCA1CA2

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
CN-103261300-B Comprise hydrazides, hydrazone and polyamines based on natural rubber and the compositions of white carbon black 米其林集团总公司 2016-08-10 CN disclosed
EP-2248833-B1 MODIFIED DIENE RUBBER, METHOD FOR PRODUCING THE SAME, RUBBER COMPOSITION USING THE SAME, AND TIRE BRIDGESTONE CORP (JP) 2014-03-26 EP disclosed
CN-102099380-B Modified diene rubber, method for producing same, rubber composition using same, and tire BRIDGESTONE CORP 2014-03-12 CN disclosed
US-20130289165-A1 COMPOSITION BASED ON NATURAL RUBBER AND CARBON BLACK COMPRISING A HYDRAZIDE, A HYDRAZONE AND A POLYAMINE MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2013-10-31 US disclosed
CN-103261300-A Composition based on natural rubber and carbon black comprising hydrazide, hydrazone and polyamine MICHELIN RECH TECH 2013-08-21 CN disclosed
US-8389641-B2 Modified diene rubber, production method thereof, and rubber composition and tire using the rubber BRIDGESTONE CORPORATION (JP) 2013-03-05 US disclosed
CN-102099380-A Modified diene rubber, method for producing the same, rubber composition using the same, and tire BRIDGESTONE CORP 2011-06-15 CN disclosed
US-20110003911-A1 MODIFIED DIENE RUBBER, PRODUCTION METHOD THEREOF, AND RUBBER COMPOSITION AND TIRE USING THE RUBBER BRIDGESTONE CORPORATION (JP) 2011-01-06 US disclosed
EP-2248833-A1 MODIFIED DIENE RUBBER, METHOD FOR PRODUCING THE SAME, RUBBER COMPOSITION USING THE SAME, AND TIRE Bridgestone Corporation (JP) 2010-11-10 EP disclosed
US-20100249336-A1 MODIFIED NATURAL RUBBER AND METHOD FOR PRODUCING SAME, AND RUBBER COMPOSITION AND TIRE USING SUCH A MODIFIED NATURAL RUBBER BRIDGESTONE CORPORATION (JP) 2010-09-30 US disclosed
CN-101842393-A Modified natural rubber, process for producing the same, rubber composition and tire using the same BRIDGESTONE CORP 2010-09-22 CN disclosed
EP-2206730-A1 MODIFIED NATURAL RUBBER, PROCESS FOR PRODUCTION OF THE SAME, AND RUBBER COMPOSITION AND TIRE EACH COMPRISING THE SAME Bridgestone Corporation (JP) 2010-07-14 EP disclosed