SCHEMBL9788115

SCHEMBL9788115

C=C(C)COOCC(O)CNc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
HTT P42858 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
GPR174 Q9BXC1 1/20 0.39
DNM1 Q05193 1/20 0.38
ABCB1 P08183 4/20 0.38
GAA P10253 3/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALOX12 P18054 1/20 0.37
HSP90AA1 P07900 1/20 0.36
TLR4 O00206 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL3083085 0.89 MAPT (0.57) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL9788116 0.81 MAPT (0.51) MAPTHTTSMN1; SMN2ADRB1ADRB3
N,N'-Diphenyl-P-Phenylenediamine SCHEMBL4231187 0.78 MAPT (0.54) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL98079 0.78 MAPT (0.54) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL530315 0.76 MAPT (0.48) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL13838308 0.76 MAPT (0.59) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL11602854 0.75 MAPT (0.88) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL10526094 0.73 MAPT (0.47) MAPTHTTSMN1; SMN2DNM1GAA
SCHEMBL529792 0.73 MAPT (0.54) MAPTHTTSMN1; SMN2ADRB1ADRB3
SCHEMBL9788117 0.73 MAPT (0.50) MAPTHTTSMN1; SMN2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0265070-B1 FIBER-REINFORCED RUBBER COMPOSITION AND PRODUCTION PROCESS AND USE THEREOF UBE INDUSTRIES, LTD. (JP) 1991-10-09 EP disclosed
US-5049610-A Fiber-reinforced rubber composition and production process and use thereof UBE INDUSTRIES, LTD. (JP) 1991-09-17 US disclosed
US-5006603-A Vulcanized rubber bonded to short fine nylon fibers by a silane coupling agent; modulus, strength and crack resistance; vehicle tires UBE INDUSTRIES, LTD. (JP) 1991-04-09 US disclosed